BAS 01816399
TL;DR: BAS 01816399 (CAS 444153-50-8) is a chemical compound with molecular formula C28H22ClN3OS and molecular weight 483.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-methylphenyl)-2-[[3-cyano-6-(4-methylphenyl)-4-phenyl-2-pyridinyl]sulfanyl]acetamide
Also Known As: BAS 01816399, N-(3-Chloro-4-methylphenyl)-2-((3-cyano-4-phenyl-6-(p-tolyl)pyridin-2-yl)thio)acetamide, N-(3-chloro-4-methylphenyl)-2-[3-cyano-6-(4-methylphenyl)-4-phenylpyridin-2-yl]sulfanylacetamide, N-(3-Chloro-4-methyl-phenyl)-2-(3-cyano-4-phenyl-6-p-tolyl-pyridin-2-ylsulfanyl)-acetamide, N-(3-chloro-4-methylphenyl)-2-[3-cyano-6-(4-methylphenyl)-4-phenyl(2-pyridylth io)]acetamide
| Molecular Formula | C28H22ClN3OS |
|---|---|
| Molecular Weight | 483.12 g/mol |
| LogP | 7.28832 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 483.11722 |
| Heavy Atoms | 34 |
| Complexity | 1379.6693 |
Chemical Identifiers
| CAS Number | 444153-50-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC(=O)NC4=CC(=C(C=C4)C)Cl |
Product Overview
BAS 01816399 (CAS 444153-50-8), with molecular formula C28H22ClN3OS and molecular weight 483.12 g/mol. IUPAC: N-(3-chloro-4-methylphenyl)-2-[[3-cyano-6-(4-methylphenyl)-4-phenyl-2-pyridinyl]sulfanyl]acetamide.
Chemical Property Profile of BAS 01816399
Property Insights of BAS 01816399
The XLogP value of 7.28832 indicates that BAS 01816399 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01816399. Following Lipinski's Rule of Five, BAS 01816399 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01816399?
The CAS number of BAS 01816399 is 444153-50-8.
What is the molecular formula of BAS 01816399?
The molecular formula of BAS 01816399 is C28H22ClN3OS.
What is the molecular weight of BAS 01816399?
The molecular weight of BAS 01816399 is 483.12 g/mol.
Where can I buy BAS 01816399?
You can request a quote for BAS 01816399 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01816399?
Yes, KEHONG BIO provides custom synthesis services for BAS 01816399 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.