2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol
TL;DR: 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol (CAS 896841-48-8) is a chemical compound with molecular formula C25H20F3N3O3 and molecular weight 467.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-phenylmethoxyphenol
Also Known As: 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol, 2-[2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-(benzyloxy)phenol, 2-[2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-(phenylmet hoxy)phenol, (6Z)-6-[2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]-3-phenylmethoxycyclohexa-2,4-dien-1-one, 6-[2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]-3-phenylmethoxycyclohexa-2,4-dien-1-one
| Molecular Formula | C25H20F3N3O3 |
|---|---|
| Molecular Weight | 467.15 g/mol |
| LogP | 5.7048 |
| Topological Polar Surface Area | 90.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 467.1457 |
| Heavy Atoms | 34 |
| Complexity | 1312.0382 |
Chemical Identifiers
| CAS Number | 896841-48-8 |
|---|---|
| SMILES | COC1=CC=CC=C1C2=C(N=C(N=C2C(F)(F)F)N)C3=C(C=C(C=C3)OCC4=CC=CC=C4)O |
Product Overview
2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol (CAS 896841-48-8), with molecular formula C25H20F3N3O3 and molecular weight 467.15 g/mol. IUPAC: 2-[2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-phenylmethoxyphenol.
Chemical Property Profile of 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol
Property Insights of 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol
The XLogP value of 5.7048 indicates that 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol. Following Lipinski's Rule of Five, 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol?
The CAS number of 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol is 896841-48-8.
What is the molecular formula of 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol?
The molecular formula of 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol is C25H20F3N3O3.
What is the molecular weight of 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol?
The molecular weight of 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol is 467.15 g/mol.
Where can I buy 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol?
You can request a quote for 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-(benzyloxy)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.