4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol
TL;DR: 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol (CAS 348131-44-2) is a chemical compound with molecular formula C17H10F3N3O3 and molecular weight 361.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-2-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]phenol
Also Known As: BIM-0021006.P001, 4-nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol, 4-nitro-2-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]phenol, 4-nitro-6-[2-phenyl-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one, (6Z)-4-nitro-6-[2-phenyl-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C17H10F3N3O3 |
|---|---|
| Molecular Weight | 361.07 g/mol |
| LogP | 4.4432 |
| Topological Polar Surface Area | 89.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.0674 |
| Heavy Atoms | 26 |
| Complexity | 975.9774 |
Chemical Identifiers
| CAS Number | 348131-44-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=CC(=N2)C(F)(F)F)C3=C(C=CC(=C3)[N+](=O)[O-])O |
Product Overview
4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol (CAS 348131-44-2), with molecular formula C17H10F3N3O3 and molecular weight 361.07 g/mol. IUPAC: 4-nitro-2-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]phenol.
Chemical Property Profile of 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol
Property Insights of 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol
The XLogP value of 4.4432 indicates that 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol. Following Lipinski's Rule of Five, 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol has 1 hydrogen bond donor(s) and 5 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-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol?
The CAS number of 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol is 348131-44-2.
What is the molecular formula of 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol?
The molecular formula of 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol is C17H10F3N3O3.
What is the molecular weight of 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol?
The molecular weight of 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol is 361.07 g/mol.
Where can I buy 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol?
You can request a quote for 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitro-2-(2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.