General Information of the Compound
| Compound ID |
CP0577975
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-benzyl-N-[[4-methoxy-2-(trifluoromethyl)phenyl]methyl]-2-oxo-3H-benzimidazole-5-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H20F3N3O3
|
||||||||||||||||||
| Molecular Weight |
455.436
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(CNC(=O)c2ccc3n(Cc4ccccc4)c(=O)[nH]c3c2)c(c1)C(F)(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H20F3N3O3/c1-33-18-9-7-17(19(12-18)24(25,26)27)13-28-22(31)16-8-10-21-20(11-16)29-23(32)30(21)14-15-5-3-2-4-6-15/h2-12H,13-14H2,1H3,(H,28,31)(H,29,32)
Show/Hide
|
||||||||||||||||||
| InChIKey |
WZXYPFYAYZHGEC-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