General Information of the Compound
| Compound ID |
CP0541334
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[4-[bis(2-methylpropyl)amino]-3-[(4-methylphenyl)carbamoylamino]phenyl]-N-methylsulfonylbenzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C30H38N4O4S
|
||||||||||||||||||
| Molecular Weight |
550.725
|
||||||||||||||||||
| Canonical SMILES |
CC(C)CN(CC(C)C)c1ccc(cc1NC(=O)Nc1ccc(C)cc1)-c1ccccc1C(=O)NS(C)(=O)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C30H38N4O4S/c1-20(2)18-34(19-21(3)4)28-16-13-23(25-9-7-8-10-26(25)29(35)33-39(6,37)38)17-27(28)32-30(36)31-24-14-11-22(5)12-15-24/h7-17,20-21H,18-19H2,1-6H3,(H,33,35)(H2,31,32,36)
Show/Hide
|
||||||||||||||||||
| InChIKey |
HIVIXBQINYFQKW-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