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Benznidazole structure, CAS 22994-85-0

Benznidazole

CAS Number22994-85-0

SynonymsMFCD00243089; N-benzyl-2-(2-nitroimidazol-1-yl)acetamide

Molecular FormulaC12H12N4O3

Molecular Weight260.25

Purity97%

Density1.35g/cm3

Boiling Point

Melting Point189-192 °C (lit.)

Flash Point

Appearancepowder

EINECS

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Symboltransportation

Signal WordWarning

Cat. No.: 2A-1178568 Purity: 97%
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Quality Control of [ 22994-85-0 ] Purity: 97% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number22994-85-0
Catalog No.2A-1178568
Chinese Name苄硝唑
SynonymsMFCD00243089; N-benzyl-2-(2-nitroimidazol-1-yl)acetamide
Molecular FormulaC12H12N4O3
Molecular Weight260.25
Purity97
Density1.35g/cm3
Melting Point189-192 °C (lit.)
Appearancepowder
Storage ConditionStore in an airtight, cool and dry place, ensuring
ApplicationBenznidazol (Ro 07-1051) is an antiparasitic drug with an IC50 value of 20.35 μM against the Colombian T. cruzi strain and is currently used to treat Chagas disease.
HTC2933290090
PubChem ID24866267
MDL NumberMFCD00243089
SMILES[O-][N+](=O)c1nccn1CC(=O)NCc2ccccc2
InChI1S/C12H12N4O3/c17-11(14-8-10-4-2-1-3-5-10)9-15-7-6-13-12(15)16(18)19/h1-7H,8-9H2,(H,14,17)
InChI KeyCULUWZNBISUWAS-UHFFFAOYSA-N
NACRES CodeNA.22
UNSPSC12352100
Hazard Symbolstransportation
MSDSmsds/179212_1_22994_85_0.pdf
BioactivityBenznidazol (Ro 07-1051) is an antiparasitic medication, with an IC50 of 20.35 μM for Colombian T. cruzi strains, and has been used in the treatment of Chagas disease[1][2]. Related Catalog Signaling Pathways >> Anti-infection >> Parasite Research Areas >> Infection In Vivo Benznidazole (100 mg/kg/day, p.o., 30 days) produces a decrease in electrocardiographic alterations, fewer modifications in the affinity and density of cardiac-receptors, and few isolated areas of fibrosis in the heart, in mice infected with Trypanosoma cruzi Tulahuen strain or SGO-Z12 isolate and treated at 180 days post infection (p.i.) (i.e. chronic phase) with Benznidazole[1]. Animal Model: Mice infected with Trypanosoma cruzi Tulahuen strain or SGO-Z12[1] Dosage: 100 mg/kg/day Administration: Orally for 30 days Result: Produced a decrease in electrocardiographic alterations, fewer modifications in the affinity and density of cardiac-receptors, and few isolated areas of fibrosis in the heart. References [1]. Bustamante JM, et al. Treatment with benznidazole or thioridazine in the chronic phase of experimental Chagas disease improves cardiopathy. Int J Antimicrob Agents. 2007 Jun;29(6):733-7. [2]. Luna KP, et al. In vitro susceptibility of Trypanosoma cruzi strains from Santander, Colombia, to hexadecylphosphocholine (miltefosine), nifurtimox and benznidazole. Biomedica. 2009 Sep;29(3):448-55. Chemical & Physical Properties Density 1.35g/cm3 Melting Point 189-192ºC(lit.) Molecular Formula C12H12N4O3 Molecular Weight 260.24900 Exact Mass 260.09100 PSA 92.74000 LogP 2.02180 Index of Refraction 1.643 InChIKey CULUWZNBISUWAS-UHFFFAOYSA-N SMILES O=C(Cn1ccnc1[N+](=O)[O-])NCc1ccccc1 Storage condition -20℃
Use ofBenznidazol (Ro 07-1051) is an antiparasitic medication, with an IC50 of 20.35 μM for Colombian T. cruzi strains, and has been used in the treatment of Chagas disease[1][2]. Properties Articles37 Name Benznidazole Synonym More Synonyms Benznidazole Biological Activity Description Benznidazol (Ro 07-1051) is an antiparasitic medication, with an IC50 of 20.35 μM for Colombian T. cruzi strains, and has been used in the treatment of Chagas disease[1][2]. Related Catalog Signaling Pathways >> Anti-infection >> Parasite Research Areas >> Infection References [1]. Bustamante JM, et al. Treatment with benznidazole or thioridazine in the chronic phase of experimental Chagas disease improves cardiopathy. Int J Antimicrob Agents. 2007 Jun;29(6):733-7. [2]. Luna KP, et al. In vitro susceptibility of Trypanosoma cruzi strains from Santander, Colombia, to hexadecylphosphocholine (miltefosine), nifurtimox and benznidazole. Biomedica. 2009 Sep;29(3):448-55. Chemical & Physical Properties Molecular Formula C12H12N4O3 Exact Mass 260.09100 PSA 92.74000 LogP 2.02180 Index of Refraction 1.643 InChIKey CULUWZNBISUWAS-UHFFFAOYSA-N Storage condition -20℃
Tax Rebate13.0%
SupervisionNone. MFN tariff: 6.5%. Ordinary tariff: 20.0%
Transport InfoShipping Name: UN
MSDS Transport InfoModule 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 The above information is believed to be correct, but is not all-inclusive and should be used as a guide only. The information in this document is based on our current knowledge and is Correct safety instructions apply to this product. This information does not represent a warranty as to the properties of this product. See reverse side of invoice or packing slip.
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