![2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid structure](/static/products/7171/717131-40-3.webp)
2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid
TL;DR: 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid (CAS 717131-40-3) is a chemical compound with molecular formula C18H17NO4 and molecular weight 311.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-methylamino]benzoic acid
Also Known As: 2-[3-(4-METHOXYPHENYL)-N-METHYLPROP-2-ENAMIDO]BENZOIC ACID, 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-methylamino]benzoic acid, 2-{[3-(4-Methoxy-phenyl)-acryloyl]-methyl-amino}-benzoic acid, 2-([3-(4-Methoxy-phenyl)-acryloyl]-methyl-amino)-benzoic acid, 2-(3-(4-METHOXYPHENYL)-N-METHYLACRYLAMIDO)BENZOIC ACID
| Molecular Formula | C18H17NO4 |
|---|---|
| Molecular Weight | 311.12 g/mol |
| LogP | 3.0696 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.11575 |
| Heavy Atoms | 23 |
| Complexity | 734.9417 |
Chemical Identifiers
| CAS Number | 717131-40-3 |
|---|---|
| SMILES | CN(C1=CC=CC=C1C(=O)O)C(=O)/C=C/C2=CC=C(C=C2)OC |
Product Overview
2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid (CAS 717131-40-3), with molecular formula C18H17NO4 and molecular weight 311.12 g/mol. IUPAC: 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-methylamino]benzoic acid.
Chemical Property Profile of 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid
Property Insights of 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid
The XLogP value of 3.0696 indicates that 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid. Following Lipinski's Rule of Five, 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid has 1 hydrogen bond donor(s) and 3 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-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid?
The CAS number of 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid is 717131-40-3.
What is the molecular formula of 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid?
The molecular formula of 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid is C18H17NO4.
What is the molecular weight of 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid?
The molecular weight of 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid is 311.12 g/mol.
Where can I buy 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid?
You can request a quote for 2-[3-(4-Methoxyphenyl)-N-methylprop-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 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(4-Methoxyphenyl)-N-methylprop-2-enamido]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.