![3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid structure](/static/products/609/609789-83-5.png)
3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid
TL;DR: 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid (CAS 609789-83-5) is a chemical compound with molecular formula C19H16ClN3O3S and molecular weight 401.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-chloro-5-[(E)-[(2-methylphenyl)hydrazinylidene]methyl]-2-oxo-1,3-thiazol-3-yl]methyl]benzoic acid
Also Known As: 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid, (E)-3-((4-chloro-2-oxo-5-((2-(o-tolyl)hydrazono)methyl)thiazol-3(2H)-yl)methyl)benzoic acid, 3-{[4-chloro-5-{(E)-[2-(2-methylphenyl)hydrazinylidene]methyl}-2-oxo-1,3-thiazol-3(2H)-yl]methyl}benzoic acid
| Molecular Formula | C19H16ClN3O3S |
|---|---|
| Molecular Weight | 401.06 g/mol |
| LogP | 4.06412 |
| Topological Polar Surface Area | 83.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.0601 |
| Heavy Atoms | 27 |
| Complexity | 1072.057 |
Chemical Identifiers
| CAS Number | 609789-83-5 |
|---|---|
| SMILES | CC1=CC=CC=C1N/N=C/C2=C(N(C(=O)S2)CC3=CC(=CC=C3)C(=O)O)Cl |
Product Overview
3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid (CAS 609789-83-5), with molecular formula C19H16ClN3O3S and molecular weight 401.06 g/mol. IUPAC: 3-[[4-chloro-5-[(E)-[(2-methylphenyl)hydrazinylidene]methyl]-2-oxo-1,3-thiazol-3-yl]methyl]benzoic acid.
Chemical Property Profile of 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid
Property Insights of 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid
The XLogP value of 4.06412 indicates that 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid. Following Lipinski's Rule of Five, 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid has 2 hydrogen bond donor(s) and 5 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 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid?
The CAS number of 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid is 609789-83-5.
What is the molecular formula of 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid?
The molecular formula of 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid is C19H16ClN3O3S.
What is the molecular weight of 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid?
The molecular weight of 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid is 401.06 g/mol.
Where can I buy 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid?
You can request a quote for 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-Chloro-2-oxo-5-(o-tolyl-hydrazonomethyl)-thiazol-3-ylmethyl]-benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.