BAS 01516557
TL;DR: BAS 01516557 (CAS 332376-72-4) is a chemical compound with molecular formula C19H19N5OS and molecular weight 365.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methylphenyl)-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: BAS 01516557, N-(3-methylphenyl)-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide, 2-((4-allyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(m-tolyl)acetamide, 2-(4-Allyl-5-pyridin-4-yl-4H-[1,2,4]triazol-3-ylsulfanyl)-N-m-tolyl-acetamide, N-(3-methylphenyl)-2-(4-prop-2-enyl-5-(4-pyridyl)(1,2,4-triazol-3-ylthio))acet amide
| Molecular Formula | C19H19N5OS |
|---|---|
| Molecular Weight | 365.13 g/mol |
| LogP | 3.56532 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 365.13104 |
| Heavy Atoms | 26 |
| Complexity | 907.3028 |
Chemical Identifiers
| CAS Number | 332376-72-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=NC=C3 |
Product Overview
BAS 01516557 (CAS 332376-72-4), with molecular formula C19H19N5OS and molecular weight 365.13 g/mol. IUPAC: N-(3-methylphenyl)-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 01516557
Property Insights of BAS 01516557
The XLogP value of 3.56532 indicates that BAS 01516557 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01516557. Following Lipinski's Rule of Five, BAS 01516557 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 01516557?
The CAS number of BAS 01516557 is 332376-72-4.
What is the molecular formula of BAS 01516557?
The molecular formula of BAS 01516557 is C19H19N5OS.
What is the molecular weight of BAS 01516557?
The molecular weight of BAS 01516557 is 365.13 g/mol.
Where can I buy BAS 01516557?
You can request a quote for BAS 01516557 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01516557?
Yes, KEHONG BIO provides custom synthesis services for BAS 01516557 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.