AN-465/13570102
TL;DR: AN-465/13570102 (CAS 353500-86-4) is a chemical compound with molecular formula C18H16Cl2N6O2S and molecular weight 450.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(3,4-dichlorophenyl)methyl]-1,3-dimethyl-8-(1-methylimidazol-2-yl)sulfanylpurine-2,6-dione
Also Known As: AN-465/13570102, A2339/0098715, 7-[(3,4-dichlorophenyl)methyl]-1,3-dimethyl-8-(1-methylimidazol-2-yl)sulfanylpurine-2,6-dione, 7-(3,4-dichlorobenzyl)-1,3-dimethyl-8-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione, 7-[(3,4-dichlorophenyl)methyl]-1,3-dimethyl-8-(1-methylimidazol-2-ylthio)-1,3, 7-trihydropurine-2,6-dione
| Molecular Formula | C18H16Cl2N6O2S |
|---|---|
| Molecular Weight | 450.04 g/mol |
| LogP | 2.6735 |
| Topological Polar Surface Area | 79.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 450.04324 |
| Heavy Atoms | 29 |
| Complexity | 1367.4196 |
Chemical Identifiers
| CAS Number | 353500-86-4 |
|---|---|
| SMILES | CN1C=CN=C1SC2=NC3=C(N2CC4=CC(=C(C=C4)Cl)Cl)C(=O)N(C(=O)N3C)C |
Product Overview
AN-465/13570102 (CAS 353500-86-4), with molecular formula C18H16Cl2N6O2S and molecular weight 450.04 g/mol. IUPAC: 7-[(3,4-dichlorophenyl)methyl]-1,3-dimethyl-8-(1-methylimidazol-2-yl)sulfanylpurine-2,6-dione.
Chemical Property Profile of AN-465/13570102
Property Insights of AN-465/13570102
The XLogP value of 2.6735 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-465/13570102. The TPSA of 79.64 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-465/13570102. Following Lipinski's Rule of Five, AN-465/13570102 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-465/13570102?
The CAS number of AN-465/13570102 is 353500-86-4.
What is the molecular formula of AN-465/13570102?
The molecular formula of AN-465/13570102 is C18H16Cl2N6O2S.
What is the molecular weight of AN-465/13570102?
The molecular weight of AN-465/13570102 is 450.04 g/mol.
Where can I buy AN-465/13570102?
You can request a quote for AN-465/13570102 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/13570102?
Yes, KEHONG BIO provides custom synthesis services for AN-465/13570102 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.