General Information of the Compound
| Compound ID |
CP0527934
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
7-[[4-(trifluoromethoxy)phenyl]methoxy]-4-(trifluoromethyl)chromen-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H10F6O4
|
||||||||||||||||||
| Molecular Weight |
404.262
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(F)Oc1ccc(COc2ccc3c(cc(=O)oc3c2)C(F)(F)F)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H10F6O4/c19-17(20,21)14-8-16(25)27-15-7-12(5-6-13(14)15)26-9-10-1-3-11(4-2-10)28-18(22,23)24/h1-8H,9H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
RNNSPKXDBSYGQM-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 | |||||||||||||||||||
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