4'-Nitro-3-(4-pyridyl)-acrylphenone
TL;DR: 4'-Nitro-3-(4-pyridyl)-acrylphenone (CAS 61196-75-6) is a chemical compound with molecular formula C14H10N2O3 and molecular weight 254.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenyl)-3-pyridin-4-ylprop-2-en-1-one
Also Known As: 4'-nitro-3-(4-pyridyl)-acrylphenone, 1-(4-nitrophenyl)-3-pyridin-4-ylprop-2-en-1-one, (Z)-1-(4-nitrophenyl)-3-pyridin-4-ylprop-2-en-1-one
| Molecular Formula | C14H10N2O3 |
|---|---|
| Molecular Weight | 254.07 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 75.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.06914 |
| Heavy Atoms | 19 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 61196-75-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)C=CC2=CC=NC=C2)[N+](=O)[O-] |
| InChIKey | OYRATWHQQZLJES-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4'-Nitro-3-(4-pyridyl)-acrylphenone (CAS 61196-75-6), with molecular formula C14H10N2O3 and molecular weight 254.07 g/mol. IUPAC: 1-(4-nitrophenyl)-3-pyridin-4-ylprop-2-en-1-one.
Chemical Property Profile of 4'-Nitro-3-(4-pyridyl)-acrylphenone
Property Insights of 4'-Nitro-3-(4-pyridyl)-acrylphenone
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4'-Nitro-3-(4-pyridyl)-acrylphenone. The TPSA of 75.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4'-Nitro-3-(4-pyridyl)-acrylphenone. Following Lipinski's Rule of Five, 4'-Nitro-3-(4-pyridyl)-acrylphenone 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 4'-Nitro-3-(4-pyridyl)-acrylphenone?
The CAS number of 4'-Nitro-3-(4-pyridyl)-acrylphenone is 61196-75-6.
What is the molecular formula of 4'-Nitro-3-(4-pyridyl)-acrylphenone?
The molecular formula of 4'-Nitro-3-(4-pyridyl)-acrylphenone is C14H10N2O3.
What is the molecular weight of 4'-Nitro-3-(4-pyridyl)-acrylphenone?
The molecular weight of 4'-Nitro-3-(4-pyridyl)-acrylphenone is 254.07 g/mol.
Where can I buy 4'-Nitro-3-(4-pyridyl)-acrylphenone?
You can request a quote for 4'-Nitro-3-(4-pyridyl)-acrylphenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Nitro-3-(4-pyridyl)-acrylphenone?
Yes, KEHONG BIO provides custom synthesis services for 4'-Nitro-3-(4-pyridyl)-acrylphenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.