BAS 00635256
TL;DR: BAS 00635256 (CAS 328540-20-1) is a chemical compound with molecular formula C31H21N3O4S and molecular weight 531.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyano-2-methyl-6-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-N,4-diphenylpyridine-3-carboxamide
Also Known As: BAS 00635256, AE-848/34780046, 5-cyano-2-methyl-6-{[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]sulfanyl}-N,4-diphenylpyridine-3-carboxamide, 5-Cyano-2-methyl-6-[2-oxo-2-(2-oxo-2H-chromen-3-yl)-ethylsulfanyl]-4,N-diphenyl-nicotinamide, 5-cyano-2-methyl-6-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-N,4-diphenylpyridine-3-carboxamide
| Molecular Formula | C31H21N3O4S |
|---|---|
| Molecular Weight | 531.13 g/mol |
| LogP | 6.2624 |
| Topological Polar Surface Area | 113.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 531.1253 |
| Heavy Atoms | 39 |
| Complexity | 1810.0015 |
Chemical Identifiers
| CAS Number | 328540-20-1 |
|---|---|
| SMILES | CC1=C(C(=C(C(=N1)SCC(=O)C2=CC3=CC=CC=C3OC2=O)C#N)C4=CC=CC=C4)C(=O)NC5=CC=CC=C5 |
Product Overview
BAS 00635256 (CAS 328540-20-1), with molecular formula C31H21N3O4S and molecular weight 531.13 g/mol. IUPAC: 5-cyano-2-methyl-6-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-N,4-diphenylpyridine-3-carboxamide.
Chemical Property Profile of BAS 00635256
Property Insights of BAS 00635256
The XLogP value of 6.2624 indicates that BAS 00635256 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.06 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00635256. Following Lipinski's Rule of Five, BAS 00635256 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00635256?
The CAS number of BAS 00635256 is 328540-20-1.
What is the molecular formula of BAS 00635256?
The molecular formula of BAS 00635256 is C31H21N3O4S.
What is the molecular weight of BAS 00635256?
The molecular weight of BAS 00635256 is 531.13 g/mol.
Where can I buy BAS 00635256?
You can request a quote for BAS 00635256 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00635256?
Yes, KEHONG BIO provides custom synthesis services for BAS 00635256 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.