ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate
TL;DR: ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate (CAS 79722-84-2) is a chemical compound with molecular formula C15H16N2O3 and molecular weight 272.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate
Also Known As: ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate, (E)-ethyl 2-acetamido-3-(1H-indol-3-yl)acrylate, Ethyl 2-(acetylamino)-3-(1H-indol-3-yl)acrylate, (E)-2-Acetylamino-3-(1H-indol-3-yl)-acrylic acid ethyl ester, (E)-2-acetamido-3-(1H-indol-3-yl)acrylic acid ethyl ester
| Molecular Formula | C15H16N2O3 |
|---|---|
| Molecular Weight | 272.12 g/mol |
| LogP | 2.208 |
| Topological Polar Surface Area | 71.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.1161 |
| Heavy Atoms | 20 |
| Complexity | 670.5634 |
Chemical Identifiers
| CAS Number | 79722-84-2 |
|---|---|
| SMILES | CCOC(=O)/C(=C\C1=CNC2=CC=CC=C21)/NC(=O)C |
Product Overview
ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate (CAS 79722-84-2), with molecular formula C15H16N2O3 and molecular weight 272.12 g/mol. IUPAC: ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate.
Chemical Property Profile of ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate
Property Insights of ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate
The XLogP value of 2.208 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate. The TPSA of 71.19 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate. Following Lipinski's Rule of Five, ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate has 2 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 ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate?
The CAS number of ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate is 79722-84-2.
What is the molecular formula of ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate?
The molecular formula of ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate is C15H16N2O3.
What is the molecular weight of ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate?
The molecular weight of ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate is 272.12 g/mol.
Where can I buy ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate?
You can request a quote for ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (E)-2-acetamido-3-(1H-indol-3-yl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.