(2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile
TL;DR: (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile (CAS 896855-05-3) is a chemical compound with molecular formula C20H15N3O and molecular weight 313.12 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-(1H-indol-3-yl)prop-2-enenitrile
Also Known As: (E)-3-(1H-indol-3-yl)-2-(indoline-1-carbonyl)acrylonitrile, (E)-2-(2,3-dihydroindole-1-carbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile, (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile
| Molecular Formula | C20H15N3O |
|---|---|
| Molecular Weight | 313.12 g/mol |
| LogP | 3.66418 |
| Topological Polar Surface Area | 59.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.12152 |
| Heavy Atoms | 24 |
| Complexity | 1006.89594 |
Chemical Identifiers
| CAS Number | 896855-05-3 |
|---|---|
| SMILES | C1CN(C2=CC=CC=C21)C(=O)/C(=C/C3=CNC4=CC=CC=C43)/C#N |
Product Overview
(2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile (CAS 896855-05-3), with molecular formula C20H15N3O and molecular weight 313.12 g/mol. IUPAC: (E)-2-(2,3-dihydroindole-1-carbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile.
Chemical Property Profile of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile
Property Insights of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile
The XLogP value of 3.66418 indicates that (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.89 Ų, (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile has 1 hydrogen bond donor(s) and 2 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-(1H-indol-3-yl)prop-2-enenitrile?
The CAS number of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile is 896855-05-3.
What is the molecular formula of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile?
The molecular formula of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile is C20H15N3O.
What is the molecular weight of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile?
The molecular weight of (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile is 313.12 g/mol.
Where can I buy (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile?
You can request a quote for (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)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-(1H-indol-3-yl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-(2,3-dihydro-1H-indol-1-ylcarbonyl)-3-(1H-indol-3-yl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.