F6548-3178
TL;DR: F6548-3178 (CAS 896381-29-6) is a chemical compound with molecular formula C21H19F3N4O3 and molecular weight 432.14 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]-1H-quinazoline-2,4-dione
Also Known As: F6548-3178, 3-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]-1H-quinazoline-2,4-dione, 3-(2-oxo-2-(4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)ethyl)quinazoline-2,4(1H,3H)-dione, 3-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione
| Molecular Formula | C21H19F3N4O3 |
|---|---|
| Molecular Weight | 432.14 g/mol |
| LogP | 2.0574 |
| Topological Polar Surface Area | 78.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 432.14093 |
| Heavy Atoms | 31 |
| Complexity | 1240.829 |
Chemical Identifiers
| CAS Number | 896381-29-6 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)CN3C(=O)C4=CC=CC=C4NC3=O |
Product Overview
F6548-3178 (CAS 896381-29-6), with molecular formula C21H19F3N4O3 and molecular weight 432.14 g/mol. IUPAC: 3-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]-1H-quinazoline-2,4-dione.
Chemical Property Profile of F6548-3178
Property Insights of F6548-3178
The XLogP value of 2.0574 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F6548-3178. The TPSA of 78.41 Ų falls within the moderate polarity range, balancing permeability and solubility for F6548-3178. Following Lipinski's Rule of Five, F6548-3178 has 1 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 F6548-3178?
The CAS number of F6548-3178 is 896381-29-6.
What is the molecular formula of F6548-3178?
The molecular formula of F6548-3178 is C21H19F3N4O3.
What is the molecular weight of F6548-3178?
The molecular weight of F6548-3178 is 432.14 g/mol.
Where can I buy F6548-3178?
You can request a quote for F6548-3178 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F6548-3178?
Yes, KEHONG BIO provides custom synthesis services for F6548-3178 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.