AB00680464-01
TL;DR: AB00680464-01 (CAS 577762-15-3) is a chemical compound with molecular formula C14H12ClN5O2S and molecular weight 349.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-chlorophenyl)acetamide
Also Known As: AB00680464-01, 2-((4-amino-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(3-chlorophenyl)acetamide, 2-{[4-amino-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-chlorophenyl)acetamide, F2649-0128, 2-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-chlorophenyl)acetamide
| Molecular Formula | C14H12ClN5O2S |
|---|---|
| Molecular Weight | 349.04 g/mol |
| LogP | 2.6361 |
| Topological Polar Surface Area | 98.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.04 |
| Heavy Atoms | 23 |
| Complexity | 818.4493 |
Chemical Identifiers
| CAS Number | 577762-15-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC(=O)CSC2=NN=C(N2N)C3=CC=CO3 |
Product Overview
AB00680464-01 (CAS 577762-15-3), with molecular formula C14H12ClN5O2S and molecular weight 349.04 g/mol. IUPAC: 2-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-chlorophenyl)acetamide.
Chemical Property Profile of AB00680464-01
Property Insights of AB00680464-01
The XLogP value of 2.6361 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00680464-01. The TPSA of 98.97 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00680464-01. Following Lipinski's Rule of Five, AB00680464-01 has 2 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 AB00680464-01?
The CAS number of AB00680464-01 is 577762-15-3.
What is the molecular formula of AB00680464-01?
The molecular formula of AB00680464-01 is C14H12ClN5O2S.
What is the molecular weight of AB00680464-01?
The molecular weight of AB00680464-01 is 349.04 g/mol.
Where can I buy AB00680464-01?
You can request a quote for AB00680464-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00680464-01?
Yes, KEHONG BIO provides custom synthesis services for AB00680464-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.