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Home > Products > Pharmaceuticals & Life Science > Pharmaceutical Intermediates > (2S,3S,4R,5R)-5-(2-CHLORO-6-((3-IODOBENZYL)AMINO)-9H-PURIN-9-YL)-3,4-DIHYDROXY-N-METHYLTETRAHYDROFURAN-2-CARBOXAMIDE
(2S,3S,4R,5R)-5-(2-CHLORO-6-((3-IODOBENZYL)AMINO)-9H-PURIN-9-YL)-3,4-DIHYDROXY-N-METHYLTETRAHYDROFURAN-2-CARBOXAMIDE structure, CAS 163042-96-4

(2S,3S,4R,5R)-5-(2-CHLORO-6-((3-IODOBENZYL)AMINO)-9H-PURIN-9-YL)-3,4-DIHYDROXY-N-METHYLTETRAHYDROFURAN-2-CARBOXAMIDE

CAS Number163042-96-4

SynonymsCF102; CI-IB-MECA; 2-Cl-IB-Meca; Cl-IB-MECA; Namodenoson; 2-chloro-IB-MECA; CF-102; CF-102(2-Cl-IB-MECA)

Molecular FormulaC18H18ClIN6O4

Molecular Weight544.731

Purity96+%

Density2.0±0.1 g/cm3

Boiling Point

Melting Point209 °C

Flash Point

AppearanceSolid;White to Almost white powder to crystal

EINECS0

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Cat. No.: 2A-0095417 Purity: 96+%
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Quality Control of [ 163042-96-4 ] Purity: 96+% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number163042-96-4
Catalog No.2A-0095417
Chinese Name氯-IB-MECA
SynonymsCF102; CI-IB-MECA; 2-Cl-IB-Meca; Cl-IB-MECA; Namodenoson; 2-chloro-IB-MECA; CF-102; CF-102(2-Cl-IB-MECA)
Molecular FormulaC18H18ClIN6O4
Molecular Weight544.731
Purity96+
Density2.0±0.1 g/cm3
Melting Point209 °C
AppearanceSolid;White to Almost white powder to crystal
Storage Condition0-10°C; avoid heating
ApplicationNamodenoson (CF-102) is a selective A3 adenosine receptor agonist, with selectivity 2500 to 1400 times that of A1 and A2 respectively.
EINECS0
HTC2934999090
UN(IATA)0
PubChem ID7978583
SMILESCNC(=O)C1OC(n2cnc3c(NCc4cccc(I)c4)nc(Cl)nc32)C(O)C1O
InChIInChI=1S/C18H18ClIN6O4/c1-21-16(29)13-11(27)12(28)17(30-13)26-7-23-10-14(24-18(19)25-15(10)26)22-6-8-3-2-4-9(20)5-8/h2-5,7,11-13,17,27-28H,6H2,1H3,(H,21,29)(H,22,24,25)/t11-,12+,13-,17+/m0/s1
InChI KeyIPSYPUKKXMNCNQ-PFHKOEEOSA-N
BioactivityNamodenoson (CF-102) is a selective A3 adenosine receptor agonist (Ki = 0.33 nM). Displays 2500- and 1400-fold selectivity over A1 and A2A receptors respectively. Related Catalog Signaling Pathways >> GPCR/G Protein >> Adenosine Receptor Research Areas >> Cancer Target Ki:0.33 nM (A3 adenosine receptor)[1][2]. In Vitro In human ADF cells of astroglial lineage, 100 nM Namodenoson (2-Cl-IB-MECA) caused a marked reorganization of the cytoskeleton, with appearance of stress fibres and numerous cell protrusions. High concentrations of Namodenoson (2-Cl-IB-MECA) directly cause influx of Ca2+[2]. In Vivo Intravenous administration of 200 μg/kg Namodenoson (2-Cl-IB-MECA) resulted in a short-lasting hypotension, which was accompanied by a 50-100-fold increase in plasma histamine concentrations. Administration of a second dose of Namodenoson (2-Cl-IB-MECA) did not elicit any hemodynamic effects[1]. References [1]. Van Schaick EA et al. Hemodynamic effects and histamine release elicited by the selective adenosine A3 receptor agonist 2-Cl-IB-MECA in conscious rats. Eur J Pharmacol. 1996 Jul 25;308(3):311-4. [2]. Jacobson KA et al. Adenosine A3 receptors: novel ligands and paradoxical effects. Trends Pharmacol Sci. 1998 May;19(5):184-91. Chemical & Physical Properties Density 2.0±0.1 g/cm3 Melting Point 209 °C Molecular Formula C18H18ClIN6O4 Molecular Weight 544.731 Exact Mass 544.012268 PSA 134.42000 LogP 3.14 Index of Refraction 1.814 InChIKey IPSYPUKKXMNCNQ-PFHKOEEOSA-N SMILES CNC(=O)C1OC(n2cnc3c(NCc4cccc(I)c4)nc(Cl)nc32)C(O)C1O
Use ofNamodenoson (CF-102) is a selective A3 adenosine receptor agonist (Ki = 0.33 nM). Displays 2500- and 1400-fold selectivity over A1 and A2A receptors respectively. Properties Name (2S,3S,4R,5R)-5-[2-chloro-6-[(3-iodophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide Synonym More Synonyms 2-CL-IB-MECA Biological Activity Description Namodenoson (CF-102) is a selective A3 adenosine receptor agonist (Ki = 0.33 nM). Displays 2500- and 1400-fold selectivity over A1 and A2A receptors respectively. Related Catalog Signaling Pathways >> GPCR/G Protein >> Adenosine Receptor Research Areas >> Cancer Ki:0.33 nM (A3 adenosine receptor)[1][2]. In Vitro In human ADF cells of astroglial lineage, 100 nM Namodenoson (2-Cl-IB-MECA) caused a marked reorganization of the cytoskeleton, with appearance of stress fibres and numerous cell protrusions. High concentrations of Namodenoson (2-Cl-IB-MECA) directly cause influx of Ca2+[2]. In Vivo Intravenous administration of 200 μg/kg Namodenoson (2-Cl-IB-MECA) resulted in a short-lasting hypotension, which was accompanied by a 50-100-fold increase in plasma histamine concentrations. Administration of a second dose of Namodenoson (2-Cl-IB-MECA) did not elicit any hemodynamic effects[1]. References [1]. Van Schaick EA et al. Hemodynamic effects and histamine release elicited by the selective adenosine A3 receptor agonist 2-Cl-IB-MECA in conscious rats. Eur J Pharmacol. 1996 Jul 25;308(3):311-4. [2]. Jacobson KA et al. Adenosine A3 receptors: novel ligands and paradoxical effects. Trends Pharmacol Sci. 1998 May;19(5):184-91. Chemical & Physical Properties Exact Mass 544.012268 PSA 134.42000 Index of Refraction 1.814 InChIKey IPSYPUKKXMNCNQ-PFHKOEEOSA-N
Tax Rebate13.0%
SupervisionNone. MFN tariff: 6.5%. Ordinary tariff: 20.0%
Transport InfoProduct name: Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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