3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid
TL;DR: 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid (CAS 840459-00-9) is a chemical compound with molecular formula C22H22N2O5 and molecular weight 394.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[(E)-3-(4-methoxyphenyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoyl]amino]propanoic acid
Also Known As: 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid, 3-[[(E)-3-(4-methoxyphenyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoyl]amino]propanoic acid, 3-[[3-(4-methoxyphenyl)-2-(3-phenylprop-2-enoylamino)prop-2-enoyl]amino]propanoic Acid, N-[(2E)-3-(4-methoxyphenyl)-2-{[(2E)-3-phenylprop-2-enoyl]amino}prop-2-enoyl]-beta-alanine
| Molecular Formula | C22H22N2O5 |
|---|---|
| Molecular Weight | 394.15 g/mol |
| LogP | 2.4566 |
| Topological Polar Surface Area | 104.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 394.15286 |
| Heavy Atoms | 29 |
| Complexity | 902.5597 |
Chemical Identifiers
| CAS Number | 840459-00-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C(\C(=O)NCCC(=O)O)/NC(=O)/C=C/C2=CC=CC=C2 |
Product Overview
3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid (CAS 840459-00-9), with molecular formula C22H22N2O5 and molecular weight 394.15 g/mol. IUPAC: 3-[[(E)-3-(4-methoxyphenyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoyl]amino]propanoic acid.
Chemical Property Profile of 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid
Property Insights of 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid
The XLogP value of 2.4566 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid. The TPSA of 104.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid. Following Lipinski's Rule of Five, 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid has 3 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 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid?
The CAS number of 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid is 840459-00-9.
What is the molecular formula of 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid?
The molecular formula of 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid is C22H22N2O5.
What is the molecular weight of 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid?
The molecular weight of 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid is 394.15 g/mol.
Where can I buy 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid?
You can request a quote for 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-((E)-2-cinnamamido-3-(4-methoxyphenyl)acrylamido)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.