BAS 02223775
TL;DR: BAS 02223775 (CAS 333323-58-3) is a chemical compound with molecular formula C20H21ClN4OS and molecular weight 400.11 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-(4-ethylphenyl)acetamide
Also Known As: BAS 02223775, 2-{[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethylphenyl)acetamide, 2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethylphenyl)acetamide, 2-((5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N-(4-ethylphenyl)acetamide, 2-[5-(4-chlorophenyl)-4-ethyl(1,2,4-triazol-3-ylthio)]-N-(4-ethylphenyl)acetam ide
| Molecular Formula | C20H21ClN4OS |
|---|---|
| Molecular Weight | 400.11 g/mol |
| LogP | 4.9116 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 400.11246 |
| Heavy Atoms | 27 |
| Complexity | 906.7361 |
Chemical Identifiers
| CAS Number | 333323-58-3 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC)C3=CC=C(C=C3)Cl |
Product Overview
BAS 02223775 (CAS 333323-58-3), with molecular formula C20H21ClN4OS and molecular weight 400.11 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethylphenyl)acetamide.
Chemical Property Profile of BAS 02223775
Property Insights of BAS 02223775
The XLogP value of 4.9116 indicates that BAS 02223775 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 02223775 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 02223775 has 1 hydrogen bond donor(s) and 4 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 02223775?
The CAS number of BAS 02223775 is 333323-58-3.
What is the molecular formula of BAS 02223775?
The molecular formula of BAS 02223775 is C20H21ClN4OS.
What is the molecular weight of BAS 02223775?
The molecular weight of BAS 02223775 is 400.11 g/mol.
Where can I buy BAS 02223775?
You can request a quote for BAS 02223775 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02223775?
Yes, KEHONG BIO provides custom synthesis services for BAS 02223775 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.