General Information of the Compound
| Compound ID |
CP0449133
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(R)-3-benzyl-4-(2,2,2-trifluoroethyl)-10-(trifluoromethyl)-3,4-dihydro-2H-[1,4]oxazino[2,3-f]quinolin-8(7H)-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H16F6N2O2
|
||||||||||||||||||
| Molecular Weight |
442.359
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(F)CN1[C@H](Cc2ccccc2)COc2c1ccc1[nH]c(=O)cc(c21)C(F)(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H16F6N2O2/c22-20(23,24)11-29-13(8-12-4-2-1-3-5-12)10-31-19-16(29)7-6-15-18(19)14(21(25,26)27)9-17(30)28-15/h1-7,9,13H,8,10-11H2,(H,28,30)/t13-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
OZCWLRIIYUZOSU-CYBMUJFWSA-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