2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile
TL;DR: 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile (CAS 313069-40-8) is a chemical compound with molecular formula C20H23NO5 and molecular weight 357.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile
Also Known As: 2-(3,4-dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile
| Molecular Formula | C20H23NO5 |
|---|---|
| Molecular Weight | 357.16 g/mol |
| LogP | 3.57948 |
| Topological Polar Surface Area | 69.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 357.15762 |
| Heavy Atoms | 26 |
| Complexity | 772.26904 |
Chemical Identifiers
| CAS Number | 313069-40-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(CC2=CC(=C(C(=C2)OC)OC)OC)C#N)OC |
Product Overview
2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile (CAS 313069-40-8), with molecular formula C20H23NO5 and molecular weight 357.16 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile.
Chemical Property Profile of 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile
Property Insights of 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile
The XLogP value of 3.57948 indicates that 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile. Following Lipinski's Rule of Five, 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile has 0 hydrogen bond donor(s) and 6 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-(3,4,5-trimethoxyphenyl)propanenitrile?
The CAS number of 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile is 313069-40-8.
What is the molecular formula of 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile?
The molecular formula of 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile is C20H23NO5.
What is the molecular weight of 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile?
The molecular weight of 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile is 357.16 g/mol.
Where can I buy 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile?
You can request a quote for 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile 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-(3,4,5-trimethoxyphenyl)propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.