BAS 04025361
TL;DR: BAS 04025361 (CAS 557063-75-9) is a chemical compound with molecular formula C16H14FN5OS and molecular weight 343.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-fluorophenyl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: BAS 04025361, N-(3-fluorophenyl)-2-{[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(3-fluorophenyl)-2-((4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(3-fluorophenyl)-2-(4-methyl-5-(4-pyridyl)(1,2,4-triazol-3-ylthio))acetamide, N-(3-fluorophenyl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
| Molecular Formula | C16H14FN5OS |
|---|---|
| Molecular Weight | 343.09 g/mol |
| LogP | 2.747 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.0903 |
| Heavy Atoms | 24 |
| Complexity | 852.6839 |
Chemical Identifiers
| CAS Number | 557063-75-9 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)F)C3=CC=NC=C3 |
Product Overview
BAS 04025361 (CAS 557063-75-9), with molecular formula C16H14FN5OS and molecular weight 343.09 g/mol. IUPAC: N-(3-fluorophenyl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 04025361
Property Insights of BAS 04025361
The XLogP value of 2.747 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04025361. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04025361. Following Lipinski's Rule of Five, BAS 04025361 has 1 hydrogen bond donor(s) and 5 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 BAS 04025361?
The CAS number of BAS 04025361 is 557063-75-9.
What is the molecular formula of BAS 04025361?
The molecular formula of BAS 04025361 is C16H14FN5OS.
What is the molecular weight of BAS 04025361?
The molecular weight of BAS 04025361 is 343.09 g/mol.
Where can I buy BAS 04025361?
You can request a quote for BAS 04025361 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04025361?
Yes, KEHONG BIO provides custom synthesis services for BAS 04025361 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.