![4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol structure](/static/products/4778/477846-98-3.webp)
4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol
TL;DR: 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol (CAS 477846-98-3) 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.
4-[4-(4-bromophenyl)pyrimidin-2-yl]phenol
Also Known As: 4-[4-(4-bromophenyl)-2-pyrimidinyl]benzenol, 4-[4-(4-bromophenyl)pyrimidin-2-yl]phenol, 4-[6-(4-bromophenyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one
| Molecular Formula | C16H11BrN2O |
|---|---|
| Molecular Weight | 326.01 g/mol |
| LogP | 4.2787 |
| Topological Polar Surface Area | 46.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.0055 |
| Heavy Atoms | 20 |
| Complexity | 663.4705 |
Chemical Identifiers
| CAS Number | 477846-98-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NC=CC(=N2)C3=CC=C(C=C3)Br)O |
Product Overview
4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol (CAS 477846-98-3), with molecular formula C16H11BrN2O and molecular weight 326.01 g/mol. IUPAC: 4-[4-(4-bromophenyl)pyrimidin-2-yl]phenol.
Chemical Property Profile of 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol
Property Insights of 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol
The XLogP value of 4.2787 indicates that 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.01 Ų, 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol has 1 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 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol?
The CAS number of 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol is 477846-98-3.
What is the molecular formula of 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol?
The molecular formula of 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol is C16H11BrN2O.
What is the molecular weight of 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol?
The molecular weight of 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol is 326.01 g/mol.
Where can I buy 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol?
You can request a quote for 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(4-Bromophenyl)-2-pyrimidinyl]benzenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.