BAS 01269297
TL;DR: BAS 01269297 (CAS 337354-66-2) is a chemical compound with molecular formula C20H17ClN4OS2 and molecular weight 428.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-chlorophenyl)-1H-imidazol-2-yl]sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Also Known As: BAS 01269297, 2-((5-(4-Chlorophenyl)-1H-imidazol-2-yl)thio)-N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)acetamide, 2-[[5-(4-chlorophenyl)-1H-imidazol-2-yl]sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide, 2-[5-(4-Chloro-phenyl)-1H-imidazol-2-ylsulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-benzo[b]thiophen-2-yl)-acetamide, 2-[5-(4-chlorophenyl)imidazol-2-ylthio]-N-(3-cyano(4,5,6,7-tetrahydrobenzo[b]t hiophen-2-yl))acetamide
| Molecular Formula | C20H17ClN4OS2 |
|---|---|
| Molecular Weight | 428.05 g/mol |
| LogP | 5.27288 |
| Topological Polar Surface Area | 81.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.05322 |
| Heavy Atoms | 28 |
| Complexity | 1049.3379 |
Chemical Identifiers
| CAS Number | 337354-66-2 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)CSC3=NC=C(N3)C4=CC=C(C=C4)Cl)C#N |
Product Overview
BAS 01269297 (CAS 337354-66-2), with molecular formula C20H17ClN4OS2 and molecular weight 428.05 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-1H-imidazol-2-yl]sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide.
Chemical Property Profile of BAS 01269297
Property Insights of BAS 01269297
The XLogP value of 5.27288 indicates that BAS 01269297 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.57 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01269297. Following Lipinski's Rule of Five, BAS 01269297 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01269297?
The CAS number of BAS 01269297 is 337354-66-2.
What is the molecular formula of BAS 01269297?
The molecular formula of BAS 01269297 is C20H17ClN4OS2.
What is the molecular weight of BAS 01269297?
The molecular weight of BAS 01269297 is 428.05 g/mol.
Where can I buy BAS 01269297?
You can request a quote for BAS 01269297 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01269297?
Yes, KEHONG BIO provides custom synthesis services for BAS 01269297 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.