(Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile
TL;DR: (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile (CAS 706772-59-0) is a chemical compound with molecular formula C18H17NO4S and molecular weight 343.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile
Also Known As: (2Z)-3-[4-methoxy-3-(methoxymethyl)phenyl]-2-(phenylsulfonyl)prop-2-enenitrile, (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile
| Molecular Formula | C18H17NO4S |
|---|---|
| Molecular Weight | 343.09 g/mol |
| LogP | 3.17998 |
| Topological Polar Surface Area | 76.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 343.08783 |
| Heavy Atoms | 24 |
| Complexity | 880.9799 |
Chemical Identifiers
| CAS Number | 706772-59-0 |
|---|---|
| SMILES | COCC1=C(C=CC(=C1)/C=C(/C#N)\S(=O)(=O)C2=CC=CC=C2)OC |
Product Overview
(Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile (CAS 706772-59-0), with molecular formula C18H17NO4S and molecular weight 343.09 g/mol. IUPAC: (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile.
Chemical Property Profile of (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile
Property Insights of (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile
The XLogP value of 3.17998 indicates that (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.39 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile. Following Lipinski's Rule of Five, (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile has 0 hydrogen bond donor(s) and 5 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)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile?
The CAS number of (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile is 706772-59-0.
What is the molecular formula of (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile?
The molecular formula of (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile is C18H17NO4S.
What is the molecular weight of (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile?
The molecular weight of (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile is 343.09 g/mol.
Where can I buy (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile?
You can request a quote for (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)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 (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(benzenesulfonyl)-3-[4-methoxy-3-(methoxymethyl)phenyl]prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.