4,6-Diphenylpyrimidin-2-ol
TL;DR: 4,6-Diphenylpyrimidin-2-ol (CAS 4120-05-2) is a chemical compound with molecular formula C16H12N2O and molecular weight 248.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-diphenyl-1H-pyrimidin-2-one
Also Known As: 4,6-diphenylpyrimidin-2-ol, 4,6-diphenyl-1H-pyrimidin-2-one, H-Arg(NO2)-OH, 4,6-diphenylpyrimidin-2(1H)-one, CBChromo1_000056
| Molecular Formula | C16H12N2O |
|---|---|
| Molecular Weight | 248.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.09496 |
| Heavy Atoms | 19 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 4120-05-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC(=NC(=O)N2)C3=CC=CC=C3 |
| InChIKey | HVTASVIOKKMCLW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,6-Diphenylpyrimidin-2-ol (CAS 4120-05-2), with molecular formula C16H12N2O and molecular weight 248.09 g/mol. IUPAC: 4,6-diphenyl-1H-pyrimidin-2-one.
Chemical Property Profile of 4,6-Diphenylpyrimidin-2-ol
Property Insights of 4,6-Diphenylpyrimidin-2-ol
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Diphenylpyrimidin-2-ol. With a topological polar surface area (TPSA) of 41.5 Ų, 4,6-Diphenylpyrimidin-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Diphenylpyrimidin-2-ol has 1 hydrogen bond donor(s) and 1 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 4,6-Diphenylpyrimidin-2-ol?
The CAS number of 4,6-Diphenylpyrimidin-2-ol is 4120-05-2.
What is the molecular formula of 4,6-Diphenylpyrimidin-2-ol?
The molecular formula of 4,6-Diphenylpyrimidin-2-ol is C16H12N2O.
What is the molecular weight of 4,6-Diphenylpyrimidin-2-ol?
The molecular weight of 4,6-Diphenylpyrimidin-2-ol is 248.09 g/mol.
Where can I buy 4,6-Diphenylpyrimidin-2-ol?
You can request a quote for 4,6-Diphenylpyrimidin-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Diphenylpyrimidin-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Diphenylpyrimidin-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.