BAS 01916042
TL;DR: BAS 01916042 (CAS 332934-75-5) is a chemical compound with molecular formula C20H21ClN4O3S and molecular weight 432.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)acetamide
Also Known As: BAS 01916042, 2-{[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide, N-(2,4-dimethoxyphenyl)-2-[5-(4-chlorophenyl)-4-ethyl(1,2,4-triazol-3-ylthio)] acetamide, 2-((5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N-(2,4-dimethoxyphenyl)acetamide, 2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)acetamide
| Molecular Formula | C20H21ClN4O3S |
|---|---|
| Molecular Weight | 432.10 g/mol |
| LogP | 4.3664 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 432.1023 |
| Heavy Atoms | 29 |
| Complexity | 991.8914 |
Chemical Identifiers
| CAS Number | 332934-75-5 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)OC)OC)C3=CC=C(C=C3)Cl |
Product Overview
BAS 01916042 (CAS 332934-75-5), with molecular formula C20H21ClN4O3S and molecular weight 432.10 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)acetamide.
Chemical Property Profile of BAS 01916042
Property Insights of BAS 01916042
The XLogP value of 4.3664 indicates that BAS 01916042 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.27 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01916042. Following Lipinski's Rule of Five, BAS 01916042 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 01916042?
The CAS number of BAS 01916042 is 332934-75-5.
What is the molecular formula of BAS 01916042?
The molecular formula of BAS 01916042 is C20H21ClN4O3S.
What is the molecular weight of BAS 01916042?
The molecular weight of BAS 01916042 is 432.10 g/mol.
Where can I buy BAS 01916042?
You can request a quote for BAS 01916042 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01916042?
Yes, KEHONG BIO provides custom synthesis services for BAS 01916042 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.