2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl-
TL;DR: 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl- (CAS 22114-24-5) is a chemical compound with molecular formula C16H11N3O3 and molecular weight 293.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-nitrophenyl)-4-phenyl-1H-pyrimidin-2-one
Also Known As: 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl-, 4-(4-Nitrophenyl)-6-phenyl-2-pyrimidinol #, 6-(4-nitrophenyl)-4-phenyl-1H-pyrimidin-2-one, 4-(4-Nitrophenyl)-6-phenylpyrimidin-2(1H)-one, 6-(4-Nitrophenyl)-4-phenylpyrimidin-2(1H)-one
| Molecular Formula | C16H11N3O3 |
|---|---|
| Molecular Weight | 293.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 87.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 293.08005 |
| Heavy Atoms | 22 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 22114-24-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=O)NC(=C2)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | OJQCIEKKSDHPDV-UHFFFAOYSA-N |
Product Overview
2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl- (CAS 22114-24-5), with molecular formula C16H11N3O3 and molecular weight 293.08 g/mol. IUPAC: 6-(4-nitrophenyl)-4-phenyl-1H-pyrimidin-2-one.
Chemical Property Profile of 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl-
Property Insights of 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl-. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl-. Following Lipinski's Rule of Five, 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl- has 1 hydrogen bond donor(s) and 3 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(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl-?
The CAS number of 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl- is 22114-24-5.
What is the molecular formula of 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl-?
The molecular formula of 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl- is C16H11N3O3.
What is the molecular weight of 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl-?
The molecular weight of 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl- is 293.08 g/mol.
Where can I buy 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl-?
You can request a quote for 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2(1H)-Pyrimidinone, 4-(p-nitrophenyl)-6-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.