BAS 02876656
TL;DR: BAS 02876656 (CAS 374914-76-8) is a chemical compound with molecular formula C26H27N3O2S2 and molecular weight 477.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-cyano-7,7-dimethyl-5-oxo-4-thiophen-2-yl-1,4,6,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(2,3-dimethylphenyl)acetamide
Also Known As: BAS 02876656, 2-((3-cyano-7,7-dimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinolin-2-yl)thio)-N-(2,3-dimethylphenyl)acetamide, F1154-0027, 2-[(3-cyano-7,7-dimethyl-5-oxo-4-thiophen-2-yl-1,4,6,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(2,3-dimethylphenyl)acetamide, 2-{[3-cyano-7,7-dimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
| Molecular Formula | C26H27N3O2S2 |
|---|---|
| Molecular Weight | 477.15 g/mol |
| LogP | 5.80202 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 477.15448 |
| Heavy Atoms | 33 |
| Complexity | 1216.6569 |
Chemical Identifiers
| CAS Number | 374914-76-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC(=O)CSC2=C(C(C3=C(N2)CC(CC3=O)(C)C)C4=CC=CS4)C#N)C |
Product Overview
BAS 02876656 (CAS 374914-76-8), with molecular formula C26H27N3O2S2 and molecular weight 477.15 g/mol. IUPAC: 2-[(3-cyano-7,7-dimethyl-5-oxo-4-thiophen-2-yl-1,4,6,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(2,3-dimethylphenyl)acetamide.
Chemical Property Profile of BAS 02876656
Property Insights of BAS 02876656
The XLogP value of 5.80202 indicates that BAS 02876656 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 02876656. Following Lipinski's Rule of Five, BAS 02876656 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 02876656?
The CAS number of BAS 02876656 is 374914-76-8.
What is the molecular formula of BAS 02876656?
The molecular formula of BAS 02876656 is C26H27N3O2S2.
What is the molecular weight of BAS 02876656?
The molecular weight of BAS 02876656 is 477.15 g/mol.
Where can I buy BAS 02876656?
You can request a quote for BAS 02876656 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02876656?
Yes, KEHONG BIO provides custom synthesis services for BAS 02876656 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.