2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile
TL;DR: 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile (CAS 358392-63-9) 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.
(E)-2-(morpholine-4-carbonyl)-3-(3-phenoxyphenyl)prop-2-enenitrile
Also Known As: BAS 02251177, 2-(4-MORPHOLINYLCARBONYL)-3-(3-PHENOXYPHENYL)ACRYLONITRILE, 2-(Morpholine-4-carbonyl)-3-(3-phenoxy-phenyl)-acrylonitrile, (2E)-2-(morpholin-4-ylcarbonyl)-3-(3-phenoxyphenyl)prop-2-enenitrile, (E)-2-(morpholine-4-carbonyl)-3-(3-phenoxyphenyl)prop-2-enenitrile
| Molecular Formula | C20H18N2O3 |
|---|---|
| Molecular Weight | 334.13 g/mol |
| LogP | 3.24468 |
| Topological Polar Surface Area | 62.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 334.13174 |
| Heavy Atoms | 25 |
| Complexity | 803.19104 |
Chemical Identifiers
| CAS Number | 358392-63-9 |
|---|---|
| SMILES | C1COCCN1C(=O)/C(=C/C2=CC(=CC=C2)OC3=CC=CC=C3)/C#N |
Product Overview
2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile (CAS 358392-63-9), with molecular formula C20H18N2O3 and molecular weight 334.13 g/mol. IUPAC: (E)-2-(morpholine-4-carbonyl)-3-(3-phenoxyphenyl)prop-2-enenitrile.
Chemical Property Profile of 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile
Property Insights of 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile
The XLogP value of 3.24468 indicates that 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile. Following Lipinski's Rule of Five, 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile 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-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile?
The CAS number of 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile is 358392-63-9.
What is the molecular formula of 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile?
The molecular formula of 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile is C20H18N2O3.
What is the molecular weight of 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile?
The molecular weight of 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile is 334.13 g/mol.
Where can I buy 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile?
You can request a quote for 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Morpholinylcarbonyl)-3-(3-phenoxyphenyl)acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.