![2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid structure](/static/products/3308/330830-05-2.webp)
2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid
TL;DR: 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid (CAS 330830-05-2) is a chemical compound with molecular formula C23H16N2O4 and molecular weight 384.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic acid
Also Known As: 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid, 2-[2-cyano-3-(3-phenoxyphenyl)prop-2-enamido]benzoic acid
| Molecular Formula | C23H16N2O4 |
|---|---|
| Molecular Weight | 384.11 g/mol |
| LogP | 4.72278 |
| Topological Polar Surface Area | 99.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 384.111 |
| Heavy Atoms | 29 |
| Complexity | 1114.9767 |
Chemical Identifiers
| CAS Number | 330830-05-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=CC(=C2)C=C(C#N)C(=O)NC3=CC=CC=C3C(=O)O |
Product Overview
2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid (CAS 330830-05-2), with molecular formula C23H16N2O4 and molecular weight 384.11 g/mol. IUPAC: 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic acid.
Chemical Property Profile of 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid
Property Insights of 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid
The XLogP value of 4.72278 indicates that 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]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 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid. Following Lipinski's Rule of Five, 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]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 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid?
The CAS number of 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid is 330830-05-2.
What is the molecular formula of 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid?
The molecular formula of 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid is C23H16N2O4.
What is the molecular weight of 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid?
The molecular weight of 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid is 384.11 g/mol.
Where can I buy 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid?
You can request a quote for 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]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 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[[2-cyano-3-(3-phenoxyphenyl)prop-2-enoyl]amino]benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.