5-Phenylpyrimidine-2-carboxylic acid
TL;DR: 5-Phenylpyrimidine-2-carboxylic acid (CAS 85386-20-5) is a chemical compound with molecular formula C11H8N2O2 and molecular weight 200.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenylpyrimidine-2-carboxylic acid
Also Known As: 5-phenylpyrimidine-2-carboxylic acid, 5-Phenyl-2-pyrimidinecarboxylic acid, 2-Pyrimidinecarboxylic acid, 5-phenyl-, 5-phenylpyrimidine-2-carboxylicacid, 2-Pyrimidinecarboxylicacid,5-phenyl-
| Molecular Formula | C11H8N2O2 |
|---|---|
| Molecular Weight | 200.06 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 63.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.05858 |
| Heavy Atoms | 15 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 85386-20-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CN=C(N=C2)C(=O)O |
| InChIKey | ZONDVYAPHBZSJV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Phenylpyrimidine-2-carboxylic acid (CAS 85386-20-5), with molecular formula C11H8N2O2 and molecular weight 200.06 g/mol. IUPAC: 5-phenylpyrimidine-2-carboxylic acid.
Chemical Property Profile of 5-Phenylpyrimidine-2-carboxylic acid
Property Insights of 5-Phenylpyrimidine-2-carboxylic acid
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Phenylpyrimidine-2-carboxylic acid. The TPSA of 63.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Phenylpyrimidine-2-carboxylic acid. Following Lipinski's Rule of Five, 5-Phenylpyrimidine-2-carboxylic acid 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 5-Phenylpyrimidine-2-carboxylic acid?
The CAS number of 5-Phenylpyrimidine-2-carboxylic acid is 85386-20-5.
What is the molecular formula of 5-Phenylpyrimidine-2-carboxylic acid?
The molecular formula of 5-Phenylpyrimidine-2-carboxylic acid is C11H8N2O2.
What is the molecular weight of 5-Phenylpyrimidine-2-carboxylic acid?
The molecular weight of 5-Phenylpyrimidine-2-carboxylic acid is 200.06 g/mol.
Where can I buy 5-Phenylpyrimidine-2-carboxylic acid?
You can request a quote for 5-Phenylpyrimidine-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Phenylpyrimidine-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Phenylpyrimidine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.