General Information of the Compound
| Compound ID |
CP0445774
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[2-[2-[(E)-2-[4-(trifluoromethoxy)phenyl]ethenyl]-3H-benzimidazol-5-yl]phenyl]methanesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H18F3N3O3S
|
||||||||||||||||||
| Molecular Weight |
473.476
|
||||||||||||||||||
| Canonical SMILES |
CS(=O)(=O)Nc1ccccc1-c1ccc2[nH]c(\C=C\c3ccc(OC(F)(F)F)cc3)nc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H18F3N3O3S/c1-33(30,31)29-19-5-3-2-4-18(19)16-9-12-20-21(14-16)28-22(27-20)13-8-15-6-10-17(11-7-15)32-23(24,25)26/h2-14,29H,1H3,(H,27,28)/b13-8+
Show/Hide
|
||||||||||||||||||
| InChIKey |
WOGDLBWDHJPLGV-MDWZMJQESA-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