(Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile
TL;DR: (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile (CAS 1164474-01-4) is a chemical compound with molecular formula C18H14N2O3S and molecular weight 338.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfonyl)-3-(5-methoxy-1H-indol-3-yl)prop-2-enenitrile
Also Known As: Bionet2_001526, 2-(benzenesulfonyl)-3-(5-methoxy-1H-indol-3-yl)prop-2-enenitrile, 3-(5-methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)acrylonitrile, (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile
| Molecular Formula | C18H14N2O3S |
|---|---|
| Molecular Weight | 338.07 g/mol |
| LogP | 3.51488 |
| Topological Polar Surface Area | 82.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.0725 |
| Heavy Atoms | 24 |
| Complexity | 1058.587 |
Chemical Identifiers
| CAS Number | 1164474-01-4 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)NC=C2C=C(C#N)S(=O)(=O)C3=CC=CC=C3 |
Product Overview
(Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile (CAS 1164474-01-4), with molecular formula C18H14N2O3S and molecular weight 338.07 g/mol. IUPAC: 2-(benzenesulfonyl)-3-(5-methoxy-1H-indol-3-yl)prop-2-enenitrile.
Chemical Property Profile of (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile
Property Insights of (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile
The XLogP value of 3.51488 indicates that (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.95 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile. Following Lipinski's Rule of Five, (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile 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 (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile?
The CAS number of (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile is 1164474-01-4.
What is the molecular formula of (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile?
The molecular formula of (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile is C18H14N2O3S.
What is the molecular weight of (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile?
The molecular weight of (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile is 338.07 g/mol.
Where can I buy (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile?
You can request a quote for (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-(5-Methoxy-1H-indol-3-yl)-2-(phenylsulfonyl)-2-propenenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.