1-(4-{4-[(2-benzoylphenyl)amino]-6-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-1,3,5-triazin-2-yl}piperazin-1-yl)ethanone
AlkaPlorer ID: AK269294
Synonym: None
IUPAC Name: 1-[4-[4-(2-benzoylanilino)-6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazin-2-yl]piperazin-1-yl]ethanone
Structure
SMILES: CC(=O)N1CCN(C2=NC(NC3=CC=CC=C3C(=O)C3=CC=CC=C3)=NC(OC(C(F)(F)F)C(F)(F)F)=N2)CC1
InChI: InChI=1S/C25H22F6N6O3/c1-15(38)36-11-13-37(14-12-36)22-33-21(34-23(35-22)40-20(24(26,27)28)25(29,30)31)32-18-10-6-5-9-17(18)19(39)16-7-3-2-4-8-16/h2-10,20H,11-14H2,1H3,(H,32,33,34,35)
InChIKey: ZLLHFEHUOYYDJT-UHFFFAOYSA-N
Reference
Plant Antiviral Agents. III. Isolation of Alkaloids From Clivia miniata Regel (Amaryl-lidaceae)
PubChem CID: 2828109
SuperNatural Ⅲ: SN0473580
COCONUT: CNP0037259
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 568.478
TPSA？: 100.55
MolLogP？: 4.386700000000003
Number of H-Donors: 1
Number of H-Acceptors: 8
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Cystic fibrosis transmembrane conductance regulator | Activity | None | None | 10.1021/acs.jmedchem.6b01792 |