General Information of the Compound
Compound ID
CP0400319
Compound Name
N-[3-[(3-methylbenzoyl)amino]phenyl]-2-propan-2-ylbenzamide
    Show/Hide
Structure
Formula
C24H24N2O2
Molecular Weight
372.468
Canonical SMILES
CC(C)c1ccccc1C(=O)Nc1cccc(NC(=O)c2cccc(C)c2)c1
    Show/Hide
InChI
InChI=1S/C24H24N2O2/c1-16(2)21-12-4-5-13-22(21)24(28)26-20-11-7-10-19(15-20)25-23(27)18-9-6-8-17(3)14-18/h4-16H,1-3H3,(H,25,27)(H,26,28)
    Show/Hide
InChIKey
MUSBQWZKSXWTPU-UHFFFAOYSA-N
Physicochemical Property
logP
5.62302
Rotatable Bonds
5
Heavy Atom Count
28
Polar Areas
58.2
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Complexity
28

"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
CID: 50919318
ChEMBL ID
CHEMBL3184438
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
Protein ID: PT06019, Potassium channel subfamily K member 3
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 = 330 nM
   TI
   LI
   LO
   TS
Protein ID: PT05440, Potassium channel subfamily K member 9
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 = 1700 nM
   TI
   LI
   LO
   TS