AJ-292/14242004
TL;DR: AJ-292/14242004 (CAS 353475-33-9) is a chemical compound with molecular formula C19H12ClF3N4O2S and molecular weight 452.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-yl)-4-[N-(5-chloro-2-hydroxyphenyl)-C-methylcarbonimidoyl]-5-(trifluoromethyl)-1H-pyrazol-3-one
Also Known As: AJ-292/14242004, (4E)-2-(1,3-benzothiazol-2-yl)-4-[1-(5-chloro-2-hydroxyanilino)ethylidene]-5-(trifluoromethyl)pyrazol-3-one, (4Z)-2-(1,3-benzothiazol-2-yl)-4-[1-(5-chloro-2-hydroxyanilino)ethylidene]-5-(trifluoromethyl)pyrazol-3-one, (E)-1-(benzo[d]thiazol-2-yl)-4-(1-((5-chloro-2-hydroxyphenyl)amino)ethylidene)-3-(trifluoromethyl)-1H-pyrazol-5(4H)-one, 2-(1,3-Benzothiazol-2-yl)-4-[N-(5-chloro-2-hydroxyphenyl)-C-methylcarbonimidoyl]-5-(trifluoromethyl)-1H-pyrazol-3-one
| Molecular Formula | C19H12ClF3N4O2S |
|---|---|
| Molecular Weight | 452.03 g/mol |
| LogP | 5.2938 |
| Topological Polar Surface Area | 83.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 452.03217 |
| Heavy Atoms | 30 |
| Complexity | 1321.0608 |
Chemical Identifiers
| CAS Number | 353475-33-9 |
|---|---|
| SMILES | CC(=NC1=C(C=CC(=C1)Cl)O)C2=C(NN(C2=O)C3=NC4=CC=CC=C4S3)C(F)(F)F |
Product Overview
AJ-292/14242004 (CAS 353475-33-9), with molecular formula C19H12ClF3N4O2S and molecular weight 452.03 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yl)-4-[N-(5-chloro-2-hydroxyphenyl)-C-methylcarbonimidoyl]-5-(trifluoromethyl)-1H-pyrazol-3-one.
Chemical Property Profile of AJ-292/14242004
Property Insights of AJ-292/14242004
The XLogP value of 5.2938 indicates that AJ-292/14242004 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.27 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-292/14242004. Following Lipinski's Rule of Five, AJ-292/14242004 has 2 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 AJ-292/14242004?
The CAS number of AJ-292/14242004 is 353475-33-9.
What is the molecular formula of AJ-292/14242004?
The molecular formula of AJ-292/14242004 is C19H12ClF3N4O2S.
What is the molecular weight of AJ-292/14242004?
The molecular weight of AJ-292/14242004 is 452.03 g/mol.
Where can I buy AJ-292/14242004?
You can request a quote for AJ-292/14242004 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/14242004?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/14242004 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.