1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one
TL;DR: 1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one (CAS 21497-13-2) is a chemical compound with molecular formula C13H14N2O4 and molecular weight 262.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one
Also Known As: 4-[(2E)-3-(4-nitrophenyl)prop-2-enoyl]morpholine, 1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one, 1-morpholino-3-(4-nitrophenyl)prop-2-en-1-one, (E)-1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one
| Molecular Formula | C13H14N2O4 |
|---|---|
| Molecular Weight | 262.10 g/mol |
| LogP | 1.4668 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.09537 |
| Heavy Atoms | 19 |
| Complexity | 489.8696 |
Chemical Identifiers
| CAS Number | 21497-13-2 |
|---|---|
| SMILES | C1COCCN1C(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one (CAS 21497-13-2), with molecular formula C13H14N2O4 and molecular weight 262.10 g/mol. IUPAC: 1-morpholin-4-yl-3-(4-nitrophenyl)prop-2-en-1-one.
Chemical Property Profile of 1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one
Property Insights of 1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one
The XLogP value of 1.4668 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Morpholino-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 1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one. Following Lipinski's Rule of Five, 1-Morpholino-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 1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one?
The CAS number of 1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one is 21497-13-2.
What is the molecular formula of 1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one?
The molecular formula of 1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one is C13H14N2O4.
What is the molecular weight of 1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one?
The molecular weight of 1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one is 262.10 g/mol.
Where can I buy 1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one?
You can request a quote for 1-Morpholino-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 1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Morpholino-3-(4-nitrophenyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.