BAS 01940142
TL;DR: BAS 01940142 (CAS 482631-45-8) is a chemical compound with molecular formula C20H18ClN5OS2 and molecular weight 443.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Also Known As: BAS 01940142, 2-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide, 2-{[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothien-2-yl)acetamide, 2-{[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
| Molecular Formula | C20H18ClN5OS2 |
|---|---|
| Molecular Weight | 443.06 g/mol |
| LogP | 4.67828 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 443.06412 |
| Heavy Atoms | 29 |
| Complexity | 1097.5123 |
Chemical Identifiers
| CAS Number | 482631-45-8 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=C(C3=C(S2)CCCC3)C#N)C4=CC=C(C=C4)Cl |
Product Overview
BAS 01940142 (CAS 482631-45-8), with molecular formula C20H18ClN5OS2 and molecular weight 443.06 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide.
Chemical Property Profile of BAS 01940142
Property Insights of BAS 01940142
The XLogP value of 4.67828 indicates that BAS 01940142 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01940142. Following Lipinski's Rule of Five, BAS 01940142 has 1 hydrogen bond donor(s) and 6 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 01940142?
The CAS number of BAS 01940142 is 482631-45-8.
What is the molecular formula of BAS 01940142?
The molecular formula of BAS 01940142 is C20H18ClN5OS2.
What is the molecular weight of BAS 01940142?
The molecular weight of BAS 01940142 is 443.06 g/mol.
Where can I buy BAS 01940142?
You can request a quote for BAS 01940142 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01940142?
Yes, KEHONG BIO provides custom synthesis services for BAS 01940142 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.