AB00726201-01
TL;DR: AB00726201-01 (CAS 763100-15-8) is a chemical compound with molecular formula C13H12ClFN4O2S and molecular weight 342.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-fluorophenyl)-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: AB00726201-01, N-(3-chloro-4-fluorophenyl)-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(3-chloro-4-fluorophenyl)-2-[(4-cyclopropyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide
| Molecular Formula | C13H12ClFN4O2S |
|---|---|
| Molecular Weight | 342.04 g/mol |
| LogP | 2.4296 |
| Topological Polar Surface Area | 79.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.03534 |
| Heavy Atoms | 22 |
| Complexity | 771.64087 |
Chemical Identifiers
| CAS Number | 763100-15-8 |
|---|---|
| SMILES | C1CC1N2C(=O)NN=C2SCC(=O)NC3=CC(=C(C=C3)F)Cl |
Product Overview
AB00726201-01 (CAS 763100-15-8), with molecular formula C13H12ClFN4O2S and molecular weight 342.04 g/mol. IUPAC: N-(3-chloro-4-fluorophenyl)-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of AB00726201-01
Property Insights of AB00726201-01
The XLogP value of 2.4296 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00726201-01. The TPSA of 79.78 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00726201-01. Following Lipinski's Rule of Five, AB00726201-01 has 2 hydrogen bond donor(s) and 4 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 AB00726201-01?
The CAS number of AB00726201-01 is 763100-15-8.
What is the molecular formula of AB00726201-01?
The molecular formula of AB00726201-01 is C13H12ClFN4O2S.
What is the molecular weight of AB00726201-01?
The molecular weight of AB00726201-01 is 342.04 g/mol.
Where can I buy AB00726201-01?
You can request a quote for AB00726201-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00726201-01?
Yes, KEHONG BIO provides custom synthesis services for AB00726201-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.