3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one
TL;DR: 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one (CAS 367454-75-9) is a chemical compound with molecular formula C13H10N2O4 and molecular weight 258.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-1-phenacylpyridin-2-one
Also Known As: 3-nitro-1-phenacylpyridin-2-one, ZERO/001743, 3-nitro-1-phenacyl-pyridin-2-one, 3-nitro-1-(2-oxo-2-phenylethyl)pyridin-2(1H)-one, 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one
| Molecular Formula | C13H10N2O4 |
|---|---|
| Molecular Weight | 258.06 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 83.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.06406 |
| Heavy Atoms | 19 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 367454-75-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CN2C=CC=C(C2=O)[N+](=O)[O-] |
| InChIKey | STZUXZFCUKXUCO-UHFFFAOYSA-N |
Product Overview
3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one (CAS 367454-75-9), with molecular formula C13H10N2O4 and molecular weight 258.06 g/mol. IUPAC: 3-nitro-1-phenacylpyridin-2-one.
Chemical Property Profile of 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one
Property Insights of 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one. Following Lipinski's Rule of Five, 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-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 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one?
The CAS number of 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one is 367454-75-9.
What is the molecular formula of 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one?
The molecular formula of 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one is C13H10N2O4.
What is the molecular weight of 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one?
The molecular weight of 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one is 258.06 g/mol.
Where can I buy 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one?
You can request a quote for 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitro-1-(2-oxo-2-phenyl-ethyl)-1H-pyridin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.