6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate
TL;DR: 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate (CAS 56406-26-9) is a chemical compound with molecular formula C11H7N2O3- and molecular weight 215.05 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-carboxylate
Also Known As: 4-oxo-2-phenyl-3H-pyrimidine-5-carboxylate, 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate
| Molecular Formula | C11H7N2O3- |
|---|---|
| Molecular Weight | 215.05 g/mol |
| LogP | -0.1996 |
| Topological Polar Surface Area | 85.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.04567 |
| Heavy Atoms | 16 |
| Complexity | 575.28357 |
Chemical Identifiers
| CAS Number | 56406-26-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC=C(C(=O)N2)C(=O)[O-] |
Product Overview
6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate (CAS 56406-26-9), with molecular formula C11H7N2O3- and molecular weight 215.05 g/mol. IUPAC: 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate
Property Insights of 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate
The XLogP value of -0.1996 indicates that 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 85.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate. Following Lipinski's Rule of Five, 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate has 1 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 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate?
The CAS number of 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate is 56406-26-9.
What is the molecular formula of 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate?
The molecular formula of 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate is C11H7N2O3-.
What is the molecular weight of 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate?
The molecular weight of 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate is 215.05 g/mol.
Where can I buy 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate?
You can request a quote for 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.