General Information of the Compound
| Compound ID |
CP0420177
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(4-tert-butylphenyl)-5-[(2,4-difluorophenyl)sulfamoyl]-7-(2-oxopyrrolidin-1-yl)-2,3-dihydroindole-1-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H30F2N4O4S
|
||||||||||||||||||
| Molecular Weight |
568.646
|
||||||||||||||||||
| Canonical SMILES |
CC(C)(C)c1ccc(NC(=O)N2CCc3cc(cc(N4CCCC4=O)c23)S(=O)(=O)Nc2ccc(F)cc2F)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H30F2N4O4S/c1-29(2,3)19-6-9-21(10-7-19)32-28(37)35-14-12-18-15-22(17-25(27(18)35)34-13-4-5-26(34)36)40(38,39)33-24-11-8-20(30)16-23(24)31/h6-11,15-17,33H,4-5,12-14H2,1-3H3,(H,32,37)
Show/Hide
|
||||||||||||||||||
| InChIKey |
HWIHUBFUVPVQPG-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