CAS Number39809-25-1
SynonymsFenistil; Vectavir; peniciclovir; Penciclovirum; 9-[4-Hydroxy-3-(hydroxymethyl)butyl]guanine; 2-Amino-1,9-dihydro-9-[4-hydroxy-3-(hydroxymethyl)butyl]-6H-purin-6-one; 2-Amino-9-[4-hydroxy-3-(hydroxymethyl)butyl]-1,9-dihydro-6H-purin-6-one; Penciclovir; Adenovir; UNII-359HUE8FJC; Denavir; 2-Amino-1,9-dihydro-9-[4-hydroxy-3-(hydroxymethyl)butyl]-6H-purin-6-one,BRL-39123; 2-Amino-9-[4-hydroxy-3-(hydroxymethyl)butyl]-1H-purin-6-one; 2-AMINO-9-[4-HYDROXY-3-(HYDROXYMETHYL)BUTYL]-3,9-DIHYDROPURIN-6-ONE,CERTIFIED REFERENCE MATERIAL; MFCD00866931; 2-amino-9-[4-hydroxy-3-(hydroxymethyl)butyl]-3H-purin-6-one; Pencyclovir; 9-[4-hydroxy-3-(hydroxymethyl)but-1-yl]guanine; 2-Amino-9-[4-hydroxy-3-(hydroxymethyl)butyl]-3,9-dihydropurin-6-one
Molecular FormulaC10H15N5O3
Molecular Weight253.26
Purity98%
Density1.7±0.1 g/cm3
Boiling Point636.7±65.0 °C at 760 mmHg
Melting Point275-277°C
Appearancepowder
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 39809-25-1 |
| Catalog No. | 2A-9011910 |
| Chinese Name | 喷昔洛韦 |
| Synonyms | Fenistil; Vectavir; peniciclovir; Penciclovirum; 9-[4-Hydroxy-3-(hydroxymethyl)butyl]guanine; 2-Amino-1,9-dihydro-9-[4-hydroxy-3-(hydroxymethyl)butyl]-6H-purin-6-one; 2-Amino-9-[4-hydroxy-3-(hydroxymethyl)butyl]-1,9-dihydro-6H-purin-6-one; Penciclovir; Adenovir; UNII-359HUE8FJC; Denavir; 2-Amino-1,9-dihydro-9-[4-hydroxy-3-(hydroxymethyl)butyl]-6H-purin-6-one,BRL-39123; 2-Amino-9-[4-hydroxy-3-(hydroxymethyl)butyl]-1H-purin-6-one; 2-AMINO-9-[4-HYDROXY-3-(HYDROXYMETHYL)BUTYL]-3,9-DIHYDROPURIN-6-ONE,CERTIFIED REFERENCE MATERIAL; MFCD00866931; 2-amino-9-[4-hydroxy-3-(hydroxymethyl)butyl]-3H-purin-6-one; Pencyclovir; 9-[4-hydroxy-3-(hydroxymethyl)but-1-yl]guanine; 2-Amino-9-[4-hydroxy-3-(hydroxymethyl)butyl]-3,9-dihydropurin-6-one |
| Molecular Formula | C10H15N5O3 |
| Molecular Weight | 253.26 |
| Purity | 98 |
| Density | 1.7±0.1 g/cm3 |
| Boiling Point | 636.7±65.0 °C at 760 mmHg |
| Melting Point | 275-277°C |
| Appearance | powder |
| Water Solubility | Water solubility: Practically insoluble; water sol |
| Storage Condition | -20°C Freezer |
| Packaging | III |
| Application | Penciclovir is effective against HSV1 and 2, with IC50s of 0.04-1.8 μg/mL and 0.06-4.4 μg/mL, respectively. |
| PubChem ID | 329819986 |
| MDL Number | MFCD15142866 |
| SMILES | NC1=NC(=O)c2ncn(CCC(CO)CO)c2N1 |
| InChI | 1S/C10H15N5O3/c11-10-13-8-7(9(18)14-10)12-5-15(8)2-1-6(3-16)4-17/h5-6,16-17H,1-4H2,(H3,11,13,14,18) |
| InChI Key | JNTOCHDNEULJHD-UHFFFAOYSA-N |
| NACRES Code | NA.76 |
| UNSPSC | 51102829 |
| Hazard Symbols | 3.2 |
| MSDS | msds/11910_1_39809_25_1.pdf |
| Bioactivity | Penciclovir is reported to be potent against HSV types 1 and 2 with IC50 of 0.04-1.8 μg/mL and 0.06-4.4 μg/mL, respectively. Related Catalog Signaling Pathways >> Anti-infection >> HSV Research Areas >> Infection Target IC50: 0.04-1.8 μg/mL (HSV-1), 0.06-4.4 μg/mL (HSV-2), 1.6-8 μg/mL (VZV), 1.5-3.1 μg/mL (EBV), 51 μg/mL (HCMV)[1] In Vitro Penciclovir inhibits herpes simplex virus type 1 (HSV-1) and type 2 (HSV-2), varicella-zoster virus (VZV), epstein-Barr virus (EBV), human cytomegalovirus (HCMV) with IC50 of 0.04-1.8 μg/mL, 0.06-4.4 μg/mL,1.6-8 μg/mL, 1.5-3.1 μg/mL, 51 μg/mL, respectively. Penciclovir (PCV) is an acyclic guanine derivative (which is not commercially available as an oral agent), has a spectrum of activity and a mechanism of action similar to those of acyclovir (ACV)[1]. Cell Assay Human breast cancer cell lines MCF-7 and MDA-MB-435, glioblastoma U87MG, and embryonic kidney cells 293T are cultured at 37°C in a humidified atmosphere containing 5% CO2 in Iscove's modified Dulbecco medium or Leibovitz's L-medium and 5% fetal bovine serum (FBS). The assays are performed with slight modifications. In brief, cells are seeded into 24-well plates (5×104 cells/well) and infected 48 h later with 103 particles per cell of unmodified virus (Adtk), PEGylated virus (PEG-Adtk), or RGD-PEG-modified virus (RGD-PEG-Adtk) in triplicates in culture medium with 2% FBS and incubated for 4 h at 37°C. The incubation medium is then replaced by normal medium and cells are further incubated for 48 h. Cells are harvested and lysed with 500 μL of TK lysis buffer that contained 0.5% Nonidet P-40 (NP-40), 20 mM N-(2-hydroxyethyl) piperazine-N′-(2-ethanesulfonic acid) (HEPES) (pH 7.6), 2 mM Mg(OAc)2, 1 mM dithiothreitol, and 50 μM thymidine. The supernatant is collected after centrifugation. The samples are kept at -80°C until use. The modified and unmodified adenovirus protein concentrations are determined by the Micro BCA assay. One microgram of cell extract is incubated with HSV1-tk substrate 8-3H-Penciclovir (8-3 H-PCV). The phosphorylated tracer is separated from unphosphorylated 8-3 H-PCV with DE-81 filters. TK activity is expressed as the percentage of conversion of substrate per minute per microgram protein[2]. References [1]. Piret J, et al. Resistance of herpes simplex viruses to nucleoside analogues: mechanisms, prevalence, and management. Antimicrob Agents Chemother. 2011 Feb;55(2):459-72. [2]. Xiong Z, et al. Imaging chemically modified adenovirus for targeting tumors expressing integrin alphavbeta3 in living micewith mutant herpes simplex virus type 1 thymidine kinase PET reporter gene. J Nucl Med. 2006 Jan;47(1):130-9. Chemical & Physical Properties Density 1.7±0.1 g/cm3 Boiling Point 636.7±65.0 °C at 760 mmHg Melting Point 275-277°C Molecular Formula C10H15N5O3 Molecular Weight 253.258 Flash Point 338.9±34.3 °C Exact Mass 253.117493 PSA 130.05000 LogP -3.58 Vapour Pressure 0.0±2.0 mmHg at 25°C Index of Refraction 1.749 Storage condition -20°C Freezer |
| Use of | Penciclovir is reported to be potent against HSV types 1 and 2 with IC50 of 0.04-1.8 μg/mL and 0.06-4.4 μg/mL, respectively. Properties Name Penciclovir Synonym More Synonyms Penciclovir Biological Activity Description Penciclovir is reported to be potent against HSV types 1 and 2 with IC50 of 0.04-1.8 μg/mL and 0.06-4.4 μg/mL, respectively. Related Catalog Signaling Pathways >> Anti-infection >> HSV Research Areas >> Infection IC50: 0.04-1.8 μg/mL (HSV-1), 0.06-4.4 μg/mL (HSV-2), 1.6-8 μg/mL (VZV), 1.5-3.1 μg/mL (EBV), 51 μg/mL (HCMV)[1] In Vitro Penciclovir inhibits herpes simplex virus type 1 (HSV-1) and type 2 (HSV-2), varicella-zoster virus (VZV), epstein-Barr virus (EBV), human cytomegalovirus (HCMV) with IC50 of 0.04-1.8 μg/mL, 0.06-4.4 μg/mL,1.6-8 μg/mL, 1.5-3.1 μg/mL, 51 μg/mL, respectively. Penciclovir (PCV) is an acyclic guanine derivative (which is not commercially available as an oral agent), has a spectrum of activity and a mechanism of action similar to those of acyclovir (ACV)[1]. References [1]. Piret J, et al. Resistance of herpes simplex viruses to nucleoside analogues: mechanisms, prevalence, and management. Antimicrob Agents Chemother. 2011 Feb;55(2):459-72. [2]. Xiong Z, et al. Imaging chemically modified adenovirus for targeting tumors expressing integrin alphavbeta3 in living micewith mutant herpes simplex virus type 1 thymidine kinase PET reporter gene. J Nucl Med. 2006 Jan;47(1):130-9. Chemical & Physical Properties Molecular Formula C10H15N5O3 Exact Mass 253.117493 PSA 130.05000 LogP -3.58 Index of Refraction 1.749 |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
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