BAS 00865569
TL;DR: BAS 00865569 (CAS 277756-61-3) is a chemical compound with molecular formula C29H27N3O2S2 and molecular weight 513.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyano-6-[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl-2-methyl-N-(2-methylphenyl)-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide
Also Known As: BAS 00865569, 5-cyano-6-[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl-2-methyl-N-(2-methylphenyl)-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide, 5-cyano-6-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-2-methyl-N-(2-methylphenyl)-4-(2-thienyl)-1,4-dihydro-3-pyridinecarboxamide, 5-cyano-6-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide, {6-[2-(2,4-dimethylphenyl)-2-oxoethylthio]-5-cyano-2-methyl-4-(2-thienyl)(3-1, 4-dihydropyridyl)}-N-(2-methylphenyl)carboxamide
| Molecular Formula | C29H27N3O2S2 |
|---|---|
| Molecular Weight | 513.15 g/mol |
| LogP | 6.62414 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 513.1545 |
| Heavy Atoms | 36 |
| Complexity | 1428.946 |
Chemical Identifiers
| CAS Number | 277756-61-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3C)C4=CC=CS4)C#N)C |
Product Overview
BAS 00865569 (CAS 277756-61-3), with molecular formula C29H27N3O2S2 and molecular weight 513.15 g/mol. IUPAC: 5-cyano-6-[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl-2-methyl-N-(2-methylphenyl)-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxamide.
Chemical Property Profile of BAS 00865569
Property Insights of BAS 00865569
The XLogP value of 6.62414 indicates that BAS 00865569 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.99 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00865569. Following Lipinski's Rule of Five, BAS 00865569 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00865569?
The CAS number of BAS 00865569 is 277756-61-3.
What is the molecular formula of BAS 00865569?
The molecular formula of BAS 00865569 is C29H27N3O2S2.
What is the molecular weight of BAS 00865569?
The molecular weight of BAS 00865569 is 513.15 g/mol.
Where can I buy BAS 00865569?
You can request a quote for BAS 00865569 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00865569?
Yes, KEHONG BIO provides custom synthesis services for BAS 00865569 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.