BAS 02876754
TL;DR: BAS 02876754 (CAS 375353-86-9) is a chemical compound with molecular formula C18H14ClN3O2S2 and molecular weight 403.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-2-[(5-cyano-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyridin-6-yl)sulfanyl]acetamide
Also Known As: BAS 02876754, F1154-0277, N-(4-chlorophenyl)-2-{[3-cyano-6-oxo-4-(thiophen-2-yl)-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide, AE-848/15115131, N-(4-chlorophenyl)-2-((3-cyano-6-oxo-4-(thiophen-2-yl)-1,4,5,6-tetrahydropyridin-2-yl)thio)acetamide
| Molecular Formula | C18H14ClN3O2S2 |
|---|---|
| Molecular Weight | 403.02 g/mol |
| LogP | 4.11208 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.0216 |
| Heavy Atoms | 26 |
| Complexity | 886.1601 |
Chemical Identifiers
| CAS Number | 375353-86-9 |
|---|---|
| SMILES | C1C(C(=C(NC1=O)SCC(=O)NC2=CC=C(C=C2)Cl)C#N)C3=CC=CS3 |
Product Overview
BAS 02876754 (CAS 375353-86-9), with molecular formula C18H14ClN3O2S2 and molecular weight 403.02 g/mol. IUPAC: N-(4-chlorophenyl)-2-[(5-cyano-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyridin-6-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 02876754
Property Insights of BAS 02876754
The XLogP value of 4.11208 indicates that BAS 02876754 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 02876754. Following Lipinski's Rule of Five, BAS 02876754 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02876754?
The CAS number of BAS 02876754 is 375353-86-9.
What is the molecular formula of BAS 02876754?
The molecular formula of BAS 02876754 is C18H14ClN3O2S2.
What is the molecular weight of BAS 02876754?
The molecular weight of BAS 02876754 is 403.02 g/mol.
Where can I buy BAS 02876754?
You can request a quote for BAS 02876754 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02876754?
Yes, KEHONG BIO provides custom synthesis services for BAS 02876754 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.