(Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile
TL;DR: (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile (CAS 16612-30-9) is a chemical compound with molecular formula C18H17NO3S and molecular weight 327.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile
Also Known As: AS-871/42552966, (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile, 3-(2-ethoxyphenyl)-2-[(4-methylphenyl)sulfonyl]acrylonitrile, (2Z)-3-(2-ethoxyphenyl)-2-[(4-methylphenyl)sulfonyl]prop-2-enenitrile
| Molecular Formula | C18H17NO3S |
|---|---|
| Molecular Weight | 327.09 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 75.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.09293 |
| Heavy Atoms | 23 |
| Complexity | 559.0 |
Chemical Identifiers
| CAS Number | 16612-30-9 |
|---|---|
| SMILES | CCOC1=CC=CC=C1/C=C(/C#N)\S(=O)(=O)C2=CC=C(C=C2)C |
| InChIKey | DBPGRSGHOBHSPI-ATVHPVEESA-N |
Product Overview
(Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile (CAS 16612-30-9), with molecular formula C18H17NO3S and molecular weight 327.09 g/mol. IUPAC: (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile.
Chemical Property Profile of (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile
Property Insights of (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile
The XLogP value of 3.8 indicates that (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile. Following Lipinski's Rule of Five, (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile has 0 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-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile?
The CAS number of (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile is 16612-30-9.
What is the molecular formula of (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile?
The molecular formula of (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile is C18H17NO3S.
What is the molecular weight of (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile?
The molecular weight of (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile is 327.09 g/mol.
Where can I buy (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile?
You can request a quote for (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-(2-ethoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.