2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile
TL;DR: 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile (CAS 74272-61-0) is a chemical compound with molecular formula C18H17NO3 and molecular weight 295.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile
Also Known As: 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)acrylonitrile, 2-(3,4-dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile
| Molecular Formula | C18H17NO3 |
|---|---|
| Molecular Weight | 295.12 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 51.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 295.12085 |
| Heavy Atoms | 22 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 74272-61-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C=C(C#N)C2=CC(=C(C=C2)OC)OC |
| InChIKey | HKABZTOSZIYENZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile (CAS 74272-61-0), with molecular formula C18H17NO3 and molecular weight 295.12 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile.
Chemical Property Profile of 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile
Property Insights of 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile
The XLogP value of 3.6 indicates that 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.5 Ų, 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-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 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile?
The CAS number of 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile is 74272-61-0.
What is the molecular formula of 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile?
The molecular formula of 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile is C18H17NO3.
What is the molecular weight of 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile?
The molecular weight of 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile is 295.12 g/mol.
Where can I buy 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile?
You can request a quote for 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)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-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.