General Information of the Compound
Compound ID
CP0486815
Compound Name
4-(trifluoromethoxy)-N-(4-(trifluoromethyl)phenyl)benzamide
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Structure
Formula
C15H9F6NO2
Molecular Weight
349.23
Canonical SMILES
FC(F)(F)Oc1ccc(cc1)C(=O)Nc1ccc(cc1)C(F)(F)F
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InChI
InChI=1S/C15H9F6NO2/c16-14(17,18)10-3-5-11(6-4-10)22-13(23)9-1-7-12(8-2-9)24-15(19,20)21/h1-8H,(H,22,23)
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InChIKey
KMPOQEXYEUBVOQ-UHFFFAOYSA-N
Physicochemical Property
logP
4.8563
Rotatable Bonds
3
Heavy Atom Count
24
Polar Areas
38.33
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Complexity
24

"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).

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PubChem ID
CID: 18229223
ChEMBL ID
CHEMBL252986
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 = 220 nM
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