2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one
TL;DR: 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one (CAS 76691-32-2) is a chemical compound with molecular formula C14H16N2O4 and molecular weight 276.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one
Also Known As: 4-(2-Methyl-3-(4-nitrophenyl)-1-oxo-2-propenyl)morpholine, 2-Propen-1-one,2-methyl-1-(4-morpholinyl)-3-(4-nitrophenyl)-, Morpholine, 4-(2-methyl-3-(4-nitrophenyl)-1-oxo-2-propenyl)-
| Molecular Formula | C14H16N2O4 |
|---|---|
| Molecular Weight | 276.11 g/mol |
| LogP | 1.8569 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.111 |
| Heavy Atoms | 20 |
| Complexity | 530.6098 |
Chemical Identifiers
| CAS Number | 76691-32-2 |
|---|---|
| SMILES | CC(=CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)N2CCOCC2 |
Product Overview
2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one (CAS 76691-32-2), with molecular formula C14H16N2O4 and molecular weight 276.11 g/mol. IUPAC: 2-methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one.
Chemical Property Profile of 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one
Property Insights of 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one
The XLogP value of 1.8569 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one. The TPSA of 72.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one. Following Lipinski's Rule of Five, 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one 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-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one?
The CAS number of 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one is 76691-32-2.
What is the molecular formula of 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one?
The molecular formula of 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one is C14H16N2O4.
What is the molecular weight of 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one?
The molecular weight of 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one is 276.11 g/mol.
Where can I buy 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one?
You can request a quote for 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.