![4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid structure](/static/products/3419/341930-57-2.webp)
4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid
TL;DR: 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid (CAS 341930-57-2) is a chemical compound with molecular formula C24H18N2O4 and molecular weight 398.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(Z)-2-cyano-3-(4-phenylmethoxyphenyl)prop-2-enoyl]amino]benzoic acid
Also Known As: 4-{3-[4-(benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid, 4-[[(Z)-2-cyano-3-(4-phenylmethoxyphenyl)prop-2-enoyl]amino]benzoic acid, 4-[[2-cyano-3-(4-phenylmethoxyphenyl)prop-2-enoyl]amino]benzoic Acid
| Molecular Formula | C24H18N2O4 |
|---|---|
| Molecular Weight | 398.13 g/mol |
| LogP | 4.50948 |
| Topological Polar Surface Area | 99.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 398.12665 |
| Heavy Atoms | 30 |
| Complexity | 1096.6978 |
Chemical Identifiers
| CAS Number | 341930-57-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)/C=C(/C#N)\C(=O)NC3=CC=C(C=C3)C(=O)O |
Product Overview
4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid (CAS 341930-57-2), with molecular formula C24H18N2O4 and molecular weight 398.13 g/mol. IUPAC: 4-[[(Z)-2-cyano-3-(4-phenylmethoxyphenyl)prop-2-enoyl]amino]benzoic acid.
Chemical Property Profile of 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid
Property Insights of 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid
The XLogP value of 4.50948 indicates that 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid. Following Lipinski's Rule of Five, 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid has 2 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-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid?
The CAS number of 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid is 341930-57-2.
What is the molecular formula of 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid?
The molecular formula of 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid is C24H18N2O4.
What is the molecular weight of 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid?
The molecular weight of 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid is 398.13 g/mol.
Where can I buy 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid?
You can request a quote for 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}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-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{3-[4-(Benzyloxy)phenyl]-2-cyanoprop-2-enamido}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.