3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid
TL;DR: 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid (CAS 372089-65-1) is a chemical compound with molecular formula C16H15ClN2O2 and molecular weight 302.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-[[4-(dimethylamino)phenyl]methylideneamino]benzoic acid
Also Known As: 3-chloro-4-[(4-dimethylaminophenyl)methylideneamino]benzoic Acid, 3-chloro-4-((4-(dimethylamino)benzylidene)amino)benzoic acid, 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid
| Molecular Formula | C16H15ClN2O2 |
|---|---|
| Molecular Weight | 302.08 g/mol |
| LogP | 3.8548 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.0822 |
| Heavy Atoms | 21 |
| Complexity | 679.1764 |
Chemical Identifiers
| CAS Number | 372089-65-1 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C=NC2=C(C=C(C=C2)C(=O)O)Cl |
Product Overview
3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid (CAS 372089-65-1), with molecular formula C16H15ClN2O2 and molecular weight 302.08 g/mol. IUPAC: 3-chloro-4-[[4-(dimethylamino)phenyl]methylideneamino]benzoic acid.
Chemical Property Profile of 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid
Property Insights of 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid
The XLogP value of 3.8548 indicates that 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.9 Ų, 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid has 1 hydrogen bond donor(s) and 3 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-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid?
The CAS number of 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid is 372089-65-1.
What is the molecular formula of 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid?
The molecular formula of 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid is C16H15ClN2O2.
What is the molecular weight of 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid?
The molecular weight of 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid is 302.08 g/mol.
Where can I buy 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid?
You can request a quote for 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)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-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.