(2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid
TL;DR: (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid (CAS 799771-66-7) is a chemical compound with molecular formula C20H21NO5 and molecular weight 355.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-benzamido-3-(3,4-diethoxyphenyl)prop-2-enoic acid
Also Known As: (E)-2-benzamido-3-(3,4-diethoxyphenyl)acrylic acid, 2-benzamido-3-(3,4-diethoxyphenyl)prop-2-enoic Acid, (E)-2-benzamido-3-(3,4-diethoxyphenyl)prop-2-enoic acid, (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid
| Molecular Formula | C20H21NO5 |
|---|---|
| Molecular Weight | 355.14 g/mol |
| LogP | 3.3395 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 355.14197 |
| Heavy Atoms | 26 |
| Complexity | 799.10376 |
Chemical Identifiers
| CAS Number | 799771-66-7 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)/C=C(\C(=O)O)/NC(=O)C2=CC=CC=C2)OCC |
Product Overview
(2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid (CAS 799771-66-7), with molecular formula C20H21NO5 and molecular weight 355.14 g/mol. IUPAC: (E)-2-benzamido-3-(3,4-diethoxyphenyl)prop-2-enoic acid.
Chemical Property Profile of (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid
Property Insights of (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid
The XLogP value of 3.3395 indicates that (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid. Following Lipinski's Rule of Five, (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic 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 (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid?
The CAS number of (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid is 799771-66-7.
What is the molecular formula of (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid?
The molecular formula of (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid is C20H21NO5.
What is the molecular weight of (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid?
The molecular weight of (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid is 355.14 g/mol.
Where can I buy (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid?
You can request a quote for (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-(3,4-diethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.