![(2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile structure](/static/products/348/348577-99-1.png)
(2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile
TL;DR: (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile (CAS 348577-99-1) is a chemical compound with molecular formula C29H25ClN4O and molecular weight 480.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[1-[(2-chlorophenyl)methyl]indol-3-yl]-2-(4-phenylpiperazine-1-carbonyl)prop-2-enenitrile
Also Known As: (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile, (E)-3-(1-(2-chlorobenzyl)-1H-indol-3-yl)-2-(4-phenylpiperazine-1-carbonyl)acrylonitrile, (2E)-3-{1-[(2-chlorophenyl)methyl]indol-3-yl}-2-[(4-phenylpiperazinyl)carbonyl ]prop-2-enenitrile, (E)-3-[1-[(2-chlorophenyl)methyl]indol-3-yl]-2-(4-phenylpiperazine-1-carbonyl)prop-2-enenitrile
| Molecular Formula | C29H25ClN4O |
|---|---|
| Molecular Weight | 480.17 g/mol |
| LogP | 5.59878 |
| Topological Polar Surface Area | 52.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 480.1717 |
| Heavy Atoms | 35 |
| Complexity | 1426.1014 |
Chemical Identifiers
| CAS Number | 348577-99-1 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=C2)C(=O)/C(=C/C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5Cl)/C#N |
Product Overview
(2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile (CAS 348577-99-1), with molecular formula C29H25ClN4O and molecular weight 480.17 g/mol. IUPAC: (E)-3-[1-[(2-chlorophenyl)methyl]indol-3-yl]-2-(4-phenylpiperazine-1-carbonyl)prop-2-enenitrile.
Chemical Property Profile of (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile
Property Insights of (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile
The XLogP value of 5.59878 indicates that (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.27 Ų, (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile has 0 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 (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile?
The CAS number of (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile is 348577-99-1.
What is the molecular formula of (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile?
The molecular formula of (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile is C29H25ClN4O.
What is the molecular weight of (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile?
The molecular weight of (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile is 480.17 g/mol.
Where can I buy (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile?
You can request a quote for (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]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)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.