BAS 01940020
TL;DR: BAS 01940020 (CAS 332872-76-1) is a chemical compound with molecular formula C22H23ClN4OS and molecular weight 426.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-2-[(5-cyclohexyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: BAS 01940020, N-(4-Chloro-phenyl)-2-(5-cyclohexyl-4-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetamide, N-(4-Chlorophenyl)-2-((5-cyclohexyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)acetamide, N-(4-chlorophenyl)-2-[(5-cyclohexyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(4-chlorophenyl)-2-(5-cyclohexyl-4-phenyl(1,2,4-triazol-3-ylthio))acetamide
| Molecular Formula | C22H23ClN4OS |
|---|---|
| Molecular Weight | 426.13 g/mol |
| LogP | 5.6992 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.1281 |
| Heavy Atoms | 29 |
| Complexity | 952.7034 |
Chemical Identifiers
| CAS Number | 332872-76-1 |
|---|---|
| SMILES | C1CCC(CC1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=CC=C(C=C4)Cl |
Product Overview
BAS 01940020 (CAS 332872-76-1), with molecular formula C22H23ClN4OS and molecular weight 426.13 g/mol. IUPAC: N-(4-chlorophenyl)-2-[(5-cyclohexyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 01940020
Property Insights of BAS 01940020
The XLogP value of 5.6992 indicates that BAS 01940020 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, BAS 01940020 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01940020 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01940020?
The CAS number of BAS 01940020 is 332872-76-1.
What is the molecular formula of BAS 01940020?
The molecular formula of BAS 01940020 is C22H23ClN4OS.
What is the molecular weight of BAS 01940020?
The molecular weight of BAS 01940020 is 426.13 g/mol.
Where can I buy BAS 01940020?
You can request a quote for BAS 01940020 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01940020?
Yes, KEHONG BIO provides custom synthesis services for BAS 01940020 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.