General Information of the Compound
Compound ID
CP0378522
Compound Name
4-iodo-N-(4-(trifluoromethyl)phenyl)benzamide
    Show/Hide
Structure
Formula
C14H9F3INO
Molecular Weight
391.13
Canonical SMILES
FC(F)(F)c1ccc(NC(=O)c2ccc(I)cc2)cc1
    Show/Hide
InChI
InChI=1S/C14H9F3INO/c15-14(16,17)10-3-7-12(8-4-10)19-13(20)9-1-5-11(18)6-2-9/h1-8H,(H,19,20)
    Show/Hide
InChIKey
GYJFUHZWIDBLAA-UHFFFAOYSA-N
Physicochemical Property
logP
4.5623
Rotatable Bonds
2
Heavy Atom Count
20
Polar Areas
29.1
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Complexity
20

"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: 2684177
ChEMBL ID
CHEMBL254253
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: PT02183, Transient receptor potential cation channel subfamily V member 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 > 10000 nM
   TI
   LI
   LO
   TS