F2649-0047
TL;DR: F2649-0047 (CAS 880801-98-9) is a chemical compound with molecular formula C15H12ClFN6OS and molecular weight 378.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-4-fluorophenyl)acetamide
Also Known As: F2649-0047, 2-{[4-amino-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-chloro-4-fluorophenyl)acetamide, 2-(4-amino-5-(3-pyridyl)(1,2,4-triazol-3-ylthio))-N-(3-chloro-4-fluorophenyl)a cetamide, 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-4-fluorophenyl)acetamide, 2-((4-amino-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(3-chloro-4-fluorophenyl)acetamide
| Molecular Formula | C15H12ClFN6OS |
|---|---|
| Molecular Weight | 378.05 g/mol |
| LogP | 2.5772 |
| Topological Polar Surface Area | 98.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.0466 |
| Heavy Atoms | 25 |
| Complexity | 904.2922 |
Chemical Identifiers
| CAS Number | 880801-98-9 |
|---|---|
| SMILES | C1=CC(=CN=C1)C2=NN=C(N2N)SCC(=O)NC3=CC(=C(C=C3)F)Cl |
Product Overview
F2649-0047 (CAS 880801-98-9), with molecular formula C15H12ClFN6OS and molecular weight 378.05 g/mol. IUPAC: 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chloro-4-fluorophenyl)acetamide.
Chemical Property Profile of F2649-0047
Property Insights of F2649-0047
The XLogP value of 2.5772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2649-0047. The TPSA of 98.72 Ų falls within the moderate polarity range, balancing permeability and solubility for F2649-0047. Following Lipinski's Rule of Five, F2649-0047 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 F2649-0047?
The CAS number of F2649-0047 is 880801-98-9.
What is the molecular formula of F2649-0047?
The molecular formula of F2649-0047 is C15H12ClFN6OS.
What is the molecular weight of F2649-0047?
The molecular weight of F2649-0047 is 378.05 g/mol.
Where can I buy F2649-0047?
You can request a quote for F2649-0047 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2649-0047?
Yes, KEHONG BIO provides custom synthesis services for F2649-0047 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.