4-(4-Methoxybenzylideneamino)benzoic acid
TL;DR: 4-(4-Methoxybenzylideneamino)benzoic acid (CAS 4380-38-5) is a chemical compound with molecular formula C15H13NO3 and molecular weight 255.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-methoxyphenyl)methylideneamino]benzoic acid
Also Known As: 4-(4-Methoxybenzylideneamino)benzoic acid, 4-[(4-methoxyphenyl)methylideneamino]benzoic acid, Benzoicacid, 4-[[(4-methoxyphenyl)methylene]amino]-, 4-[(4-methoxybenzylidene)amino]benzoic acid, J1.108.124J
| Molecular Formula | C15H13NO3 |
|---|---|
| Molecular Weight | 255.09 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 255.08954 |
| Heavy Atoms | 19 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 4380-38-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C(=O)O |
| InChIKey | ATXBWEWYPPSELE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(4-Methoxybenzylideneamino)benzoic acid (CAS 4380-38-5), with molecular formula C15H13NO3 and molecular weight 255.09 g/mol. IUPAC: 4-[(4-methoxyphenyl)methylideneamino]benzoic acid.
Chemical Property Profile of 4-(4-Methoxybenzylideneamino)benzoic acid
Property Insights of 4-(4-Methoxybenzylideneamino)benzoic acid
The XLogP value of 3.3 indicates that 4-(4-Methoxybenzylideneamino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.9 Ų, 4-(4-Methoxybenzylideneamino)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Methoxybenzylideneamino)benzoic acid has 1 hydrogen bond donor(s) and 4 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 4-(4-Methoxybenzylideneamino)benzoic acid?
The CAS number of 4-(4-Methoxybenzylideneamino)benzoic acid is 4380-38-5.
What is the molecular formula of 4-(4-Methoxybenzylideneamino)benzoic acid?
The molecular formula of 4-(4-Methoxybenzylideneamino)benzoic acid is C15H13NO3.
What is the molecular weight of 4-(4-Methoxybenzylideneamino)benzoic acid?
The molecular weight of 4-(4-Methoxybenzylideneamino)benzoic acid is 255.09 g/mol.
Where can I buy 4-(4-Methoxybenzylideneamino)benzoic acid?
You can request a quote for 4-(4-Methoxybenzylideneamino)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Methoxybenzylideneamino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methoxybenzylideneamino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.