(2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile
TL;DR: (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile (CAS 898697-12-6) is a chemical compound with molecular formula C19H16N2O3 and molecular weight 320.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-(2,3-dihydroindole-1-carbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile
Also Known As: (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile, (E)-2-(2,3-Dihydro-indole-1-carbonyl)-3-(4-hydroxy-3-methoxy-phenyl)-acrylonitrile, (E)-2-(2,3-dihydroindole-1-carbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile, (E)-3-(4-hydroxy-3-methoxy-phenyl)-2-(indoline-1-carbonyl)acrylonitrile, (E)-3-(4-hydroxy-3-methoxyphenyl)-2-(indoline-1-carbonyl)acrylonitrile
| Molecular Formula | C19H16N2O3 |
|---|---|
| Molecular Weight | 320.12 g/mol |
| LogP | 2.89708 |
| Topological Polar Surface Area | 73.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.1161 |
| Heavy Atoms | 24 |
| Complexity | 865.1559 |
Chemical Identifiers
| CAS Number | 898697-12-6 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)N2CCC3=CC=CC=C32)O |
Product Overview
(2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile (CAS 898697-12-6), with molecular formula C19H16N2O3 and molecular weight 320.12 g/mol. IUPAC: (E)-2-(2,3-dihydroindole-1-carbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile.
Chemical Property Profile of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile
Property Insights of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile
The XLogP value of 2.89708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile. The TPSA of 73.56 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile. Following Lipinski's Rule of Five, (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile has 1 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)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile?
The CAS number of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile is 898697-12-6.
What is the molecular formula of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile?
The molecular formula of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile is C19H16N2O3.
What is the molecular weight of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile?
The molecular weight of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile is 320.12 g/mol.
Where can I buy (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile?
You can request a quote for (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.