![3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid structure](/static/products/227/22774-14-7.png)
3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid
TL;DR: 3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid (CAS 22774-14-7) is a chemical compound with molecular formula C17H17NO2 and molecular weight 267.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-propan-2-ylphenyl)methylideneamino]benzoic acid
Also Known As: 3-[(4-propan-2-ylphenyl)methylideneamino]benzoic Acid, (E)-3-((4-isopropylbenzylidene)amino)benzoic acid, 3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid
| Molecular Formula | C17H17NO2 |
|---|---|
| Molecular Weight | 267.13 g/mol |
| LogP | 4.2588 |
| Topological Polar Surface Area | 49.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 267.12592 |
| Heavy Atoms | 20 |
| Complexity | 627.6932 |
Chemical Identifiers
| CAS Number | 22774-14-7 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C=NC2=CC=CC(=C2)C(=O)O |
Product Overview
3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid (CAS 22774-14-7), with molecular formula C17H17NO2 and molecular weight 267.13 g/mol. IUPAC: 3-[(4-propan-2-ylphenyl)methylideneamino]benzoic acid.
Chemical Property Profile of 3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid
Property Insights of 3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid
The XLogP value of 4.2588 indicates that 3-({(E)-[4-(propan-2-yl)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 49.66 Ų, 3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid has 1 hydrogen bond donor(s) and 2 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-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid?
The CAS number of 3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid is 22774-14-7.
What is the molecular formula of 3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid?
The molecular formula of 3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid is C17H17NO2.
What is the molecular weight of 3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid?
The molecular weight of 3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid is 267.13 g/mol.
Where can I buy 3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid?
You can request a quote for 3-({(E)-[4-(propan-2-yl)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-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.