2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile
TL;DR: 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile (CAS 5219-36-3) is a chemical compound with molecular formula C20H18N2O3 and molecular weight 334.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dimethoxyphenyl)-3-hydroxy-3-quinolin-4-ylpropanenitrile
Also Known As: 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile, 2-(2,4-dimethoxyphenyl)-3-hydroxy-3-quinolin-4-ylpropanenitrile
| Molecular Formula | C20H18N2O3 |
|---|---|
| Molecular Weight | 334.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.13174 |
| Heavy Atoms | 25 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 5219-36-3 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C(C#N)C(C2=CC=NC3=CC=CC=C23)O)OC |
| InChIKey | YGTROEOMVKWCFI-UHFFFAOYSA-N |
Product Overview
2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile (CAS 5219-36-3), with molecular formula C20H18N2O3 and molecular weight 334.13 g/mol. IUPAC: 2-(2,4-dimethoxyphenyl)-3-hydroxy-3-quinolin-4-ylpropanenitrile.
Chemical Property Profile of 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile
Property Insights of 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile. Following Lipinski's Rule of Five, 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile has 1 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 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile?
The CAS number of 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile is 5219-36-3.
What is the molecular formula of 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile?
The molecular formula of 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile is C20H18N2O3.
What is the molecular weight of 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile?
The molecular weight of 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile is 334.13 g/mol.
Where can I buy 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile?
You can request a quote for 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4-Dimethoxyphenyl)-3-hydroxy-3-(quinolin-4-yl)propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.