6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one
TL;DR: 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one (CAS 114857-84-0) is a chemical compound with molecular formula C16H11BrN2O and molecular weight 326.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one
Also Known As: 4-(4-bromophenyl)-6-phenyl-2-pyrimidinol, 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one, J2.358.761K, 4-(4-bromophenyl)-6-phenyl-1h-pyrimidin-2-one, AB00075415-01
| Molecular Formula | C16H11BrN2O |
|---|---|
| Molecular Weight | 326.01 g/mol |
| LogP | 3.8664 |
| Topological Polar Surface Area | 45.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.0055 |
| Heavy Atoms | 20 |
| Complexity | 779.5772 |
Chemical Identifiers
| CAS Number | 114857-84-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=O)NC(=C2)C3=CC=C(C=C3)Br |
Product Overview
6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one (CAS 114857-84-0), with molecular formula C16H11BrN2O and molecular weight 326.01 g/mol. IUPAC: 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one.
Chemical Property Profile of 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one
Property Insights of 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one
The XLogP value of 3.8664 indicates that 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.75 Ų, 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one has 1 hydrogen bond donor(s) and 2 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-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one?
The CAS number of 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one is 114857-84-0.
What is the molecular formula of 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one?
The molecular formula of 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one is C16H11BrN2O.
What is the molecular weight of 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one?
The molecular weight of 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one is 326.01 g/mol.
Where can I buy 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one?
You can request a quote for 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-(4-bromophenyl)-4-phenyl-1H-pyrimidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.