p-(p-Phenylphenacylideneamino)benzoic acid
TL;DR: p-(p-Phenylphenacylideneamino)benzoic acid (CAS 3686-70-2) is a chemical compound with molecular formula C21H15NO3 and molecular weight 329.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-oxo-2-(4-phenylphenyl)ethylidene]amino]benzoic acid
Also Known As: Xenalic acid, NCIOpen2_008846, p-(p-Phenylphenacylideneamino)benzoic acid, BENZOIC ACID, p-(p-PHENYLPHENACYLIDENEAMINO)-, Benzoic acid, p-[(p-phenylphenacylidene)amino]-
| Molecular Formula | C21H15NO3 |
|---|---|
| Molecular Weight | 329.11 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 66.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.1052 |
| Heavy Atoms | 25 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 3686-70-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C=NC3=CC=C(C=C3)C(=O)O |
| InChIKey | PCESDWWIFVPSOX-UHFFFAOYSA-N |
Product Overview
p-(p-Phenylphenacylideneamino)benzoic acid (CAS 3686-70-2), with molecular formula C21H15NO3 and molecular weight 329.11 g/mol. IUPAC: 4-[[2-oxo-2-(4-phenylphenyl)ethylidene]amino]benzoic acid.
Chemical Property Profile of p-(p-Phenylphenacylideneamino)benzoic acid
Property Insights of p-(p-Phenylphenacylideneamino)benzoic acid
The XLogP value of 4.3 indicates that p-(p-Phenylphenacylideneamino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.7 Ų falls within the moderate polarity range, balancing permeability and solubility for p-(p-Phenylphenacylideneamino)benzoic acid. Following Lipinski's Rule of Five, p-(p-Phenylphenacylideneamino)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 p-(p-Phenylphenacylideneamino)benzoic acid?
The CAS number of p-(p-Phenylphenacylideneamino)benzoic acid is 3686-70-2.
What is the molecular formula of p-(p-Phenylphenacylideneamino)benzoic acid?
The molecular formula of p-(p-Phenylphenacylideneamino)benzoic acid is C21H15NO3.
What is the molecular weight of p-(p-Phenylphenacylideneamino)benzoic acid?
The molecular weight of p-(p-Phenylphenacylideneamino)benzoic acid is 329.11 g/mol.
Where can I buy p-(p-Phenylphenacylideneamino)benzoic acid?
You can request a quote for p-(p-Phenylphenacylideneamino)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-(p-Phenylphenacylideneamino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for p-(p-Phenylphenacylideneamino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.