BAS 02053756
TL;DR: BAS 02053756 (CAS 332948-94-4) is a chemical compound with molecular formula C26H25ClN4OS and molecular weight 476.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,6-diethylphenyl)acetamide
Also Known As: BAS 02053756, 2-((5-(2-Chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-N-(2,6-diethylphenyl)acetamide, 2-[[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,6-diethylphenyl)acetamide, N-(2,6-diethylphenyl)-2-[5-(2-chlorophenyl)-4-phenyl(1,2,4-triazol-3-ylthio)]a cetamide, 2-[5-(2-Chloro-phenyl)-4-phenyl-4H-[1,2,4]triazol-3-ylsulfanyl]-N-(2,6-diethyl-phenyl)-acetamide
| Molecular Formula | C26H25ClN4OS |
|---|---|
| Molecular Weight | 476.14 g/mol |
| LogP | 6.4433 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 476.14377 |
| Heavy Atoms | 33 |
| Complexity | 1234.1489 |
Chemical Identifiers
| CAS Number | 332948-94-4 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4Cl |
Product Overview
BAS 02053756 (CAS 332948-94-4), with molecular formula C26H25ClN4OS and molecular weight 476.14 g/mol. IUPAC: 2-[[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,6-diethylphenyl)acetamide.
Chemical Property Profile of BAS 02053756
Property Insights of BAS 02053756
The XLogP value of 6.4433 indicates that BAS 02053756 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 02053756 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 02053756 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 02053756?
The CAS number of BAS 02053756 is 332948-94-4.
What is the molecular formula of BAS 02053756?
The molecular formula of BAS 02053756 is C26H25ClN4OS.
What is the molecular weight of BAS 02053756?
The molecular weight of BAS 02053756 is 476.14 g/mol.
Where can I buy BAS 02053756?
You can request a quote for BAS 02053756 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02053756?
Yes, KEHONG BIO provides custom synthesis services for BAS 02053756 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.