(E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid
TL;DR: (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid (CAS 840470-66-8) is a chemical compound with molecular formula C28H28N2O6 and molecular weight 488.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(E)-3-(3,4-diethoxyphenyl)-2-[(2-methylbenzoyl)amino]prop-2-enoyl]amino]benzoic acid
Also Known As: (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid, 4-[[(E)-3-(3,4-diethoxyphenyl)-2-[(2-methylbenzoyl)amino]prop-2-enoyl]amino]benzoic acid, 4-[[3-(3,4-diethoxyphenyl)-2-[(2-methylbenzoyl)amino]prop-2-enoyl]amino]benzoic Acid, 4-[(2E)-3-(3,4-DIETHOXYPHENYL)-2-[(2-METHYLPHENYL)FORMAMIDO]PROP-2-ENAMIDO]BENZOIC ACID, 4-{[(2E)-3-(3,4-diethoxyphenyl)-2-{[(2-methylphenyl)carbonyl]amino}prop-2-enoyl]amino}benzoic acid
| Molecular Formula | C28H28N2O6 |
|---|---|
| Molecular Weight | 488.19 g/mol |
| LogP | 4.90022 |
| Topological Polar Surface Area | 113.96 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 488.19473 |
| Heavy Atoms | 36 |
| Complexity | 1281.4523 |
Chemical Identifiers
| CAS Number | 840470-66-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)/C=C(\C(=O)NC2=CC=C(C=C2)C(=O)O)/NC(=O)C3=CC=CC=C3C)OCC |
Product Overview
(E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid (CAS 840470-66-8), with molecular formula C28H28N2O6 and molecular weight 488.19 g/mol. IUPAC: 4-[[(E)-3-(3,4-diethoxyphenyl)-2-[(2-methylbenzoyl)amino]prop-2-enoyl]amino]benzoic acid.
Chemical Property Profile of (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid
Property Insights of (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid
The XLogP value of 4.90022 indicates that (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.96 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid. Following Lipinski's Rule of Five, (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid has 3 hydrogen bond donor(s) and 5 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 (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid?
The CAS number of (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid is 840470-66-8.
What is the molecular formula of (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid?
The molecular formula of (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid is C28H28N2O6.
What is the molecular weight of (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid?
The molecular weight of (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid is 488.19 g/mol.
Where can I buy (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid?
You can request a quote for (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.