AP-853/42876773
TL;DR: AP-853/42876773 (CAS 902346-62-7) is a chemical compound with molecular formula C13H15ClN4O3S and molecular weight 342.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2,4-dimethoxyphenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: AP-853/42876773, N-(5-chloro-2,4-dimethoxyphenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(5-chloro-2,4-dimethoxyphenyl)-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(5-chloro-2,4-dimethoxy-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
| Molecular Formula | C13H15ClN4O3S |
|---|---|
| Molecular Weight | 342.06 g/mol |
| LogP | 2.2165 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 342.05533 |
| Heavy Atoms | 22 |
| Complexity | 677.3 |
Chemical Identifiers
| CAS Number | 902346-62-7 |
|---|---|
| SMILES | CN1C=NN=C1SCC(=O)NC2=CC(=C(C=C2OC)OC)Cl |
Product Overview
AP-853/42876773 (CAS 902346-62-7), with molecular formula C13H15ClN4O3S and molecular weight 342.06 g/mol. IUPAC: N-(5-chloro-2,4-dimethoxyphenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of AP-853/42876773
Property Insights of AP-853/42876773
The XLogP value of 2.2165 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AP-853/42876773. The TPSA of 78.27 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-853/42876773. Following Lipinski's Rule of Five, AP-853/42876773 has 1 hydrogen bond donor(s) and 6 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 AP-853/42876773?
The CAS number of AP-853/42876773 is 902346-62-7.
What is the molecular formula of AP-853/42876773?
The molecular formula of AP-853/42876773 is C13H15ClN4O3S.
What is the molecular weight of AP-853/42876773?
The molecular weight of AP-853/42876773 is 342.06 g/mol.
Where can I buy AP-853/42876773?
You can request a quote for AP-853/42876773 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-853/42876773?
Yes, KEHONG BIO provides custom synthesis services for AP-853/42876773 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.