1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid
TL;DR: 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid (CAS 56814-11-0) is a chemical compound with molecular formula C11H8N2O3 and molecular weight 216.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-oxo-2-phenyl-1H-pyrimidine-5-carboxylic acid
Also Known As: 4-Hydroxy-2-phenylpyrimidine-5-carboxylic acid, 4-hydroxy-2-phenyl-5-pyrimidinecarboxylic acid, 2-Amino-N-cyclohexylbenzamide, 4-Hydroxy-2-phenyl-pyrimidine-5-carboxylic acid, 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylic acid
| Molecular Formula | C11H8N2O3 |
|---|---|
| Molecular Weight | 216.05 g/mol |
| LogP | 1.1351 |
| Topological Polar Surface Area | 83.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.0535 |
| Heavy Atoms | 16 |
| Complexity | 575.28357 |
Chemical Identifiers
| CAS Number | 56814-11-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC=C(C(=O)N2)C(=O)O |
Product Overview
1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid (CAS 56814-11-0), with molecular formula C11H8N2O3 and molecular weight 216.05 g/mol. IUPAC: 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylic acid.
Chemical Property Profile of 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid
Property Insights of 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid
The XLogP value of 1.1351 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid. The TPSA of 83.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid. Following Lipinski's Rule of Five, 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid has 2 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 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid?
The CAS number of 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid is 56814-11-0.
What is the molecular formula of 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid?
The molecular formula of 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid is C11H8N2O3.
What is the molecular weight of 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid?
The molecular weight of 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid is 216.05 g/mol.
Where can I buy 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid?
You can request a quote for 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,6-Dihydro-6-oxo-2-phenyl-5-pyrimidinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.