(E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile
TL;DR: (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile (CAS 1164522-05-7) is a chemical compound with molecular formula C15H15BrN2O4 and molecular weight 366.0215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)prop-2-enenitrile
Also Known As: (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile, (2E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholin-4-ylcarbonyl)prop-2-en enitrile, (2E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholin-4-ylcarbonyl)prop-2-enenitrile, (E)-3-(3-Bromo-4-hydroxy-5-methoxy-phenyl)-2-(morpholine-4-carbonyl)-acrylonitrile, (E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)prop-2-enenitrile
Technical Specifications
| Molecular Formula | C15H15BrN2O4 |
| Molecular Weight | 366.0215 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 82.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 366.0215 Da |
| Heavy Atoms | 22 |
| Complexity | 481.0 |
| SMILES | COC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)N2CCOCC2)Br)O |
| InChIKey | DEUDULKTZVABMC-IZZDOVSWSA-N |
Chemical Property Profile of (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile
Property Insights of (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile. The TPSA of 82.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile. Following Lipinski's Rule of Five, (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile 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
What is the CAS number of (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile?
The CAS number of (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile is 1164522-05-7.
What is the molecular formula of (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile?
The molecular formula of (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile is C15H15BrN2O4.
What is the molecular weight of (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile?
The molecular weight of (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile is 366.0215 g/mol.
Where can I buy (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile?
You can request a quote for (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile?
Yes, CoreyChem provides custom synthesis services for (E)-3-(3-Bromo-4-hydroxy-5-methoxyphenyl)-2-(morpholine-4-carbonyl)acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.