N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide
TL;DR: N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide (CAS 710288-74-7) is a chemical compound with molecular formula C13H9ClN6O3S and molecular weight 364.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide
Also Known As: N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide, N-(2-chloro-5-nitrophenyl)-2-purin-6-ylthioacetamide, N-(2-chloro-5-nitro-phenyl)-2-(7H-purin-6-ylsulfanyl)acetamide
| Molecular Formula | C13H9ClN6O3S |
|---|---|
| Molecular Weight | 364.01 g/mol |
| LogP | 2.6453 |
| Topological Polar Surface Area | 126.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 364.01453 |
| Heavy Atoms | 24 |
| Complexity | 930.96594 |
Chemical Identifiers
| CAS Number | 710288-74-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])NC(=O)CSC2=NC=NC3=C2NC=N3)Cl |
Product Overview
N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide (CAS 710288-74-7), with molecular formula C13H9ClN6O3S and molecular weight 364.01 g/mol. IUPAC: N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide.
Chemical Property Profile of N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide
Property Insights of N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide
The XLogP value of 2.6453 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide. The TPSA of 126.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide. Following Lipinski's Rule of Five, N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide has 2 hydrogen bond donor(s) and 7 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 N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide?
The CAS number of N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide is 710288-74-7.
What is the molecular formula of N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide?
The molecular formula of N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide is C13H9ClN6O3S.
What is the molecular weight of N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide?
The molecular weight of N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide is 364.01 g/mol.
Where can I buy N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide?
You can request a quote for N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-chloro-5-nitrophenyl)-2-(7H-purin-6-ylsulfanyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.