(E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid
TL;DR: (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid (CAS 609789-70-0) is a chemical compound with molecular formula C26H20ClN3O4S and molecular weight 505.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-chloro-5-[(E)-[(2,2-diphenylacetyl)hydrazinylidene]methyl]-2-oxo-1,3-thiazol-3-yl]methyl]benzoic acid
Also Known As: (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid, 3-[[4-chloro-5-[(E)-[(2,2-diphenylacetyl)hydrazinylidene]methyl]-2-oxo-1,3-thiazol-3-yl]methyl]benzoic acid, 3-{[4-chloro-5-{(E)-[2-(diphenylacetyl)hydrazinylidene]methyl}-2-oxo-1,3-thiazol-3(2H)-yl]methyl}benzoic acid
| Molecular Formula | C26H20ClN3O4S |
|---|---|
| Molecular Weight | 505.09 g/mol |
| LogP | 4.5919 |
| Topological Polar Surface Area | 100.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 505.0863 |
| Heavy Atoms | 35 |
| Complexity | 1392.4948 |
Chemical Identifiers
| CAS Number | 609789-70-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)N/N=C/C3=C(N(C(=O)S3)CC4=CC(=CC=C4)C(=O)O)Cl |
Product Overview
(E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid (CAS 609789-70-0), with molecular formula C26H20ClN3O4S and molecular weight 505.09 g/mol. IUPAC: 3-[[4-chloro-5-[(E)-[(2,2-diphenylacetyl)hydrazinylidene]methyl]-2-oxo-1,3-thiazol-3-yl]methyl]benzoic acid.
Chemical Property Profile of (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid
Property Insights of (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid
The XLogP value of 4.5919 indicates that (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)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 (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid. Following Lipinski's Rule of Five, (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid 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 (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid?
The CAS number of (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid is 609789-70-0.
What is the molecular formula of (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid?
The molecular formula of (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid is C26H20ClN3O4S.
What is the molecular weight of (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid?
The molecular weight of (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid is 505.09 g/mol.
Where can I buy (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid?
You can request a quote for (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-((4-chloro-5-((2-(2,2-diphenylacetyl)hydrazono)methyl)-2-oxothiazol-3(2H)-yl)methyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.