BAS 01213500
TL;DR: BAS 01213500 (CAS 332164-89-3) is a chemical compound with molecular formula C29H25N3OS and molecular weight 463.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-4-(4-methylphenyl)-6-phenyl-2-pyridinyl]sulfanyl]-N-(3,5-dimethylphenyl)acetamide
Also Known As: BAS 01213500, 2-((3-Cyano-6-phenyl-4-(p-tolyl)pyridin-2-yl)thio)-N-(3,5-dimethylphenyl)acetamide, 2-[3-cyano-4-(4-methylphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(3,5-dimethylphenyl)acetamide, 2-(3-Cyano-6-phenyl-4-p-tolyl-pyridin-2-ylsulfanyl)-N-(3,5-dimethyl-phenyl)-acetamide, N-(3,5-dimethylphenyl)-2-[3-cyano-4-(4-methylphenyl)-6-phenyl(2-pyridylthio)]a cetamide
| Molecular Formula | C29H25N3OS |
|---|---|
| Molecular Weight | 463.17 g/mol |
| LogP | 6.94334 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 463.17184 |
| Heavy Atoms | 34 |
| Complexity | 1353.1438 |
Chemical Identifiers
| CAS Number | 332164-89-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC3=CC(=CC(=C3)C)C)C4=CC=CC=C4 |
Product Overview
BAS 01213500 (CAS 332164-89-3), with molecular formula C29H25N3OS and molecular weight 463.17 g/mol. IUPAC: 2-[[3-cyano-4-(4-methylphenyl)-6-phenyl-2-pyridinyl]sulfanyl]-N-(3,5-dimethylphenyl)acetamide.
Chemical Property Profile of BAS 01213500
Property Insights of BAS 01213500
The XLogP value of 6.94334 indicates that BAS 01213500 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 01213500. Following Lipinski's Rule of Five, BAS 01213500 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 01213500?
The CAS number of BAS 01213500 is 332164-89-3.
What is the molecular formula of BAS 01213500?
The molecular formula of BAS 01213500 is C29H25N3OS.
What is the molecular weight of BAS 01213500?
The molecular weight of BAS 01213500 is 463.17 g/mol.
Where can I buy BAS 01213500?
You can request a quote for BAS 01213500 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01213500?
Yes, KEHONG BIO provides custom synthesis services for BAS 01213500 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.