General Information of the Compound
| Compound ID |
CP0941929
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(2-ethyl-6-methylphenyl)-N-(4-methoxy-3-(trifluoromethyl)phenyl)-5-oxopyrrolidine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H23F3N2O3
|
||||||||||||||||||
| Molecular Weight |
420.431
|
||||||||||||||||||
| Canonical SMILES |
CCc1cccc(C)c1N1CC(C(=O)Nc2ccc(OC)c(C(F)(F)F)c2)CC1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H23F3N2O3/c1-4-14-7-5-6-13(2)20(14)27-12-15(10-19(27)28)21(29)26-16-8-9-18(30-3)17(11-16)22(23,24)25/h5-9,11,15H,4,10,12H2,1-3H3,(H,26,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
RHTOOKUWOWYXIW-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