AB00728649-01
TL;DR: AB00728649-01 (CAS 790290-24-3) is a chemical compound with molecular formula C13H12Cl2N4O2S and molecular weight 358.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dichlorophenyl)acetamide
Also Known As: AB00728649-01, 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dichlorophenyl)acetamide, 2-[(4-cyclopropyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dichlorophenyl)acetamide
| Molecular Formula | C13H12Cl2N4O2S |
|---|---|
| Molecular Weight | 358.01 g/mol |
| LogP | 2.9439 |
| Topological Polar Surface Area | 79.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 358.0058 |
| Heavy Atoms | 22 |
| Complexity | 769.64087 |
Chemical Identifiers
| CAS Number | 790290-24-3 |
|---|---|
| SMILES | C1CC1N2C(=O)NN=C2SCC(=O)NC3=C(C=C(C=C3)Cl)Cl |
Product Overview
AB00728649-01 (CAS 790290-24-3), with molecular formula C13H12Cl2N4O2S and molecular weight 358.01 g/mol. IUPAC: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dichlorophenyl)acetamide.
Chemical Property Profile of AB00728649-01
Property Insights of AB00728649-01
The XLogP value of 2.9439 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00728649-01. The TPSA of 79.78 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00728649-01. Following Lipinski's Rule of Five, AB00728649-01 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 AB00728649-01?
The CAS number of AB00728649-01 is 790290-24-3.
What is the molecular formula of AB00728649-01?
The molecular formula of AB00728649-01 is C13H12Cl2N4O2S.
What is the molecular weight of AB00728649-01?
The molecular weight of AB00728649-01 is 358.01 g/mol.
Where can I buy AB00728649-01?
You can request a quote for AB00728649-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00728649-01?
Yes, KEHONG BIO provides custom synthesis services for AB00728649-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.