![2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid structure](/static/products/1274/127444-19-3.webp)
2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid
TL;DR: 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid (CAS 127444-19-3) is a chemical compound with molecular formula C25H20ClN3O3 and molecular weight 445.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid
Also Known As: Benzoic acid, 2-(2-(2-((2-chlorophenyl)amino)ethyl)-4,5-dihydro-5-oxo-4-(phenylmethylene)-1H-imidazol-1-yl)-
| Molecular Formula | C25H20ClN3O3 |
|---|---|
| Molecular Weight | 445.12 g/mol |
| LogP | 5.3266 |
| Topological Polar Surface Area | 82.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 445.11932 |
| Heavy Atoms | 32 |
| Complexity | 1221.8665 |
Chemical Identifiers
| CAS Number | 127444-19-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=C2C(=O)N(C(=N2)CCNC3=CC=CC=C3Cl)C4=CC=CC=C4C(=O)O |
Product Overview
2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid (CAS 127444-19-3), with molecular formula C25H20ClN3O3 and molecular weight 445.12 g/mol. IUPAC: 2-[4-benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid.
Chemical Property Profile of 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid
Property Insights of 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid
The XLogP value of 5.3266 indicates that 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid. Following Lipinski's Rule of Five, 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid?
The CAS number of 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid is 127444-19-3.
What is the molecular formula of 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid?
The molecular formula of 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid is C25H20ClN3O3.
What is the molecular weight of 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid?
The molecular weight of 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid is 445.12 g/mol.
Where can I buy 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid?
You can request a quote for 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-Benzylidene-2-[2-(2-chloroanilino)ethyl]-5-oxoimidazol-1-yl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.