General Information of the Compound
| Compound ID |
CP0865304
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(+/-)-1-(2,2,2-trifluoroethyl)-2,9-bis(trifluoromethyl)-2,3-dihydro-1H-[1,4]oxazino[3,2-g]quinolin-7(6H)-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H9F9N2O2
|
||||||||||||||||||
| Molecular Weight |
420.231
|
||||||||||||||||||
| Canonical SMILES |
O=c1cc(C(F)(F)F)c2cc3c(cc2[nH]1)OCC(C(F)(F)F)N3CC(F)(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H9F9N2O2/c16-13(17,18)5-26-9-1-6-7(14(19,20)21)2-12(27)25-8(6)3-10(9)28-4-11(26)15(22,23)24/h1-3,11H,4-5H2,(H,25,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZRLFPURXVGRESW-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound