VU0616865-1
TL;DR: VU0616865-1 (CAS 862199-97-1) is a chemical compound with molecular formula C22H20F3N3O3 and molecular weight 431.15 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-(2-methylprop-2-enoxy)phenol
Also Known As: VU0616865-1, 2-[2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-[(2-methylprop-2-en-1-yl)oxy]phenol, 2-(2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl)-5-((2-methylallyl)oxy)phenol, F3385-1475, (6Z)-6-[2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]-3-(2-methylprop-2-enoxy)cyclohexa-2,4-dien-1-one
| Molecular Formula | C22H20F3N3O3 |
|---|---|
| Molecular Weight | 431.15 g/mol |
| LogP | 5.0807 |
| Topological Polar Surface Area | 90.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.1457 |
| Heavy Atoms | 31 |
| Complexity | 1130.7145 |
Chemical Identifiers
| CAS Number | 862199-97-1 |
|---|---|
| SMILES | CC(=C)COC1=CC(=C(C=C1)C2=C(C(=NC(=N2)N)C(F)(F)F)C3=CC=CC=C3OC)O |
Product Overview
VU0616865-1 (CAS 862199-97-1), with molecular formula C22H20F3N3O3 and molecular weight 431.15 g/mol. IUPAC: 2-[2-amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-(2-methylprop-2-enoxy)phenol.
Chemical Property Profile of VU0616865-1
Property Insights of VU0616865-1
The XLogP value of 5.0807 indicates that VU0616865-1 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 VU0616865-1. Following Lipinski's Rule of Five, VU0616865-1 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 VU0616865-1?
The CAS number of VU0616865-1 is 862199-97-1.
What is the molecular formula of VU0616865-1?
The molecular formula of VU0616865-1 is C22H20F3N3O3.
What is the molecular weight of VU0616865-1?
The molecular weight of VU0616865-1 is 431.15 g/mol.
Where can I buy VU0616865-1?
You can request a quote for VU0616865-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0616865-1?
Yes, KEHONG BIO provides custom synthesis services for VU0616865-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.