3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one
TL;DR: 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one (CAS 900888-73-5) is a chemical compound with molecular formula C21H19F3N4O2 and molecular weight 416.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]quinazolin-4-one
Also Known As: 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one, 3-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)quinazolin-4(3H)-one, 3-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]quinazolin-4-one
| Molecular Formula | C21H19F3N4O2 |
|---|---|
| Molecular Weight | 416.15 g/mol |
| LogP | 2.7641 |
| Topological Polar Surface Area | 58.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 416.146 |
| Heavy Atoms | 30 |
| Complexity | 1134.7899 |
Chemical Identifiers
| CAS Number | 900888-73-5 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)CN3C=NC4=CC=CC=C4C3=O |
Product Overview
3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one (CAS 900888-73-5), with molecular formula C21H19F3N4O2 and molecular weight 416.15 g/mol. IUPAC: 3-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]quinazolin-4-one.
Chemical Property Profile of 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one
Property Insights of 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one
The XLogP value of 2.7641 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one. With a topological polar surface area (TPSA) of 58.44 Ų, 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one has 0 hydrogen bond donor(s) and 4 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 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one?
The CAS number of 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one is 900888-73-5.
What is the molecular formula of 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one?
The molecular formula of 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one is C21H19F3N4O2.
What is the molecular weight of 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one?
The molecular weight of 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one is 416.15 g/mol.
Where can I buy 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one?
You can request a quote for 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.