![3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid structure](/static/products/609/609790-26-3.png)
3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid
TL;DR: 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid (CAS 609790-26-3) is a chemical compound with molecular formula C20H16ClN3O4S and molecular weight 429.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-chloro-5-[(E)-[(4-methylbenzoyl)hydrazinylidene]methyl]-2-oxo-1,3-thiazol-3-yl]methyl]benzoic acid
Also Known As: 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid, (E)-3-((4-chloro-5-((2-(4-methylbenzoyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid, 3-({4-chloro-5-[(E)-{2-[(4-methylphenyl)carbonyl]hydrazinylidene}methyl]-2-oxo-1,3-thiazol-3(2H)-yl}methyl)benzoic acid, 3-[[4-chloro-5-[(E)-[(4-methylbenzoyl)hydrazinylidene]methyl]-2-oxo-1,3-thiazol-3-yl]methyl]benzoic acid
| Molecular Formula | C20H16ClN3O4S |
|---|---|
| Molecular Weight | 429.06 g/mol |
| LogP | 3.38202 |
| Topological Polar Surface Area | 100.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.055 |
| Heavy Atoms | 29 |
| Complexity | 1149.2782 |
Chemical Identifiers
| CAS Number | 609790-26-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)N/N=C/C2=C(N(C(=O)S2)CC3=CC(=CC=C3)C(=O)O)Cl |
Product Overview
3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid (CAS 609790-26-3), with molecular formula C20H16ClN3O4S and molecular weight 429.06 g/mol. IUPAC: 3-[[4-chloro-5-[(E)-[(4-methylbenzoyl)hydrazinylidene]methyl]-2-oxo-1,3-thiazol-3-yl]methyl]benzoic acid.
Chemical Property Profile of 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid
Property Insights of 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid
The XLogP value of 3.38202 indicates that 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid. Following Lipinski's Rule of Five, 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-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-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid?
The CAS number of 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid is 609790-26-3.
What is the molecular formula of 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid?
The molecular formula of 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid is C20H16ClN3O4S.
What is the molecular weight of 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid?
The molecular weight of 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid is 429.06 g/mol.
Where can I buy 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid?
You can request a quote for 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-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-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{4-Chloro-5-[(4-methyl-benzoyl)-hydrazonomethyl]-2-oxo-thiazol-3-ylmethyl}-benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.