![2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile structure](/static/products/7261/726153-23-7.webp)
2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile
TL;DR: 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile (CAS 726153-23-7) is a chemical compound with molecular formula C27H30N2O2 and molecular weight 414.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methyl-1H-indole-3-carbonyl)-3-(4-octoxyphenyl)prop-2-enenitrile
Also Known As: 2-(2-methyl-1H-indole-3-carbonyl)-3-(4-octoxyphenyl)prop-2-enenitrile, 2-(2-methyl1H-indole-3-carbonyl)-3-(4-octoxyphenyl)prop-2-enenitrile, 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile, 2-Methyl-alpha-[[4-(octyloxy)phenyl]methylene]-beta-oxo-1H-indole-3-propanenitrile, 2-Methyl-I+/--[[4-(octyloxy)phenyl]methylene]-I(2)-oxo-1H-indole-3-propanenitrile
| Molecular Formula | C27H30N2O2 |
|---|---|
| Molecular Weight | 414.23 g/mol |
| LogP | 7.0055 |
| Topological Polar Surface Area | 65.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 414.23074 |
| Heavy Atoms | 31 |
| Complexity | 1084.6171 |
Chemical Identifiers
| CAS Number | 726153-23-7 |
|---|---|
| SMILES | CCCCCCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)C2=C(NC3=CC=CC=C32)C |
Product Overview
2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile (CAS 726153-23-7), with molecular formula C27H30N2O2 and molecular weight 414.23 g/mol. IUPAC: 2-(2-methyl-1H-indole-3-carbonyl)-3-(4-octoxyphenyl)prop-2-enenitrile.
Chemical Property Profile of 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile
Property Insights of 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile
The XLogP value of 7.0055 indicates that 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile. Following Lipinski's Rule of Five, 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile?
The CAS number of 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile is 726153-23-7.
What is the molecular formula of 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile?
The molecular formula of 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile is C27H30N2O2.
What is the molecular weight of 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile?
The molecular weight of 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile is 414.23 g/mol.
Where can I buy 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile?
You can request a quote for 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]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 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methyl-1H-indole-3-carbonyl)-3-[4-(octyloxy)phenyl]prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.