BAS 02053436
TL;DR: BAS 02053436 (CAS 332947-91-8) is a chemical compound with molecular formula C17H15ClN4OS and molecular weight 358.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 02053436, 2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, 2-((5-(4-CHLOROPHENYL)-4-(4-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)ACETAMIDE, 2-((5-(4-chlorophenyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)acetamide, 2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C17H15ClN4OS |
|---|---|
| Molecular Weight | 358.07 g/mol |
| LogP | 3.47352 |
| Topological Polar Surface Area | 73.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 358.06552 |
| Heavy Atoms | 24 |
| Complexity | 859.302 |
Chemical Identifiers
| CAS Number | 332947-91-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N)C3=CC=C(C=C3)Cl |
Product Overview
BAS 02053436 (CAS 332947-91-8), with molecular formula C17H15ClN4OS and molecular weight 358.07 g/mol. IUPAC: 2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 02053436
Property Insights of BAS 02053436
The XLogP value of 3.47352 indicates that BAS 02053436 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.8 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02053436. Following Lipinski's Rule of Five, BAS 02053436 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 02053436?
The CAS number of BAS 02053436 is 332947-91-8.
What is the molecular formula of BAS 02053436?
The molecular formula of BAS 02053436 is C17H15ClN4OS.
What is the molecular weight of BAS 02053436?
The molecular weight of BAS 02053436 is 358.07 g/mol.
Where can I buy BAS 02053436?
You can request a quote for BAS 02053436 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02053436?
Yes, KEHONG BIO provides custom synthesis services for BAS 02053436 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.