BAS 02833781
TL;DR: BAS 02833781 (CAS 333423-33-9) is a chemical compound with molecular formula C20H18ClF3N4O2S and molecular weight 470.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[[4-ethyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: BAS 02833781, N-(2-Chloro-5-(trifluoromethyl)phenyl)-2-((4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetamide, N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, N-(2-Chloro-5-trifluoromethyl-phenyl)-2-[4-ethyl-5-(2-methoxy-phenyl)-4H-[1,2,4]triazol-3-ylsulfanyl]-acetamide, N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-ethyl-5-(2-methoxyphenyl)(1,2,4-tr iazol-3-ylthio)]acetamide
| Molecular Formula | C20H18ClF3N4O2S |
|---|---|
| Molecular Weight | 470.08 g/mol |
| LogP | 5.3766 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 470.0791 |
| Heavy Atoms | 31 |
| Complexity | 1088.5272 |
Chemical Identifiers
| CAS Number | 333423-33-9 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)C3=CC=CC=C3OC |
Product Overview
BAS 02833781 (CAS 333423-33-9), with molecular formula C20H18ClF3N4O2S and molecular weight 470.08 g/mol. IUPAC: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[[4-ethyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BAS 02833781
Property Insights of BAS 02833781
The XLogP value of 5.3766 indicates that BAS 02833781 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02833781. Following Lipinski's Rule of Five, BAS 02833781 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02833781?
The CAS number of BAS 02833781 is 333423-33-9.
What is the molecular formula of BAS 02833781?
The molecular formula of BAS 02833781 is C20H18ClF3N4O2S.
What is the molecular weight of BAS 02833781?
The molecular weight of BAS 02833781 is 470.08 g/mol.
Where can I buy BAS 02833781?
You can request a quote for BAS 02833781 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02833781?
Yes, KEHONG BIO provides custom synthesis services for BAS 02833781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.