5-Chloro-1H-indole-7-carboxylic acid (4-tert-butyl-benzyl)-[2-(3-trifluoromethyl-phenyl)-ethyl]-amide

HCID 11670740
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Basic information

Standard SMILES
CC(C)(C)c1ccc(CN(CCc2cccc(C(F)(F)F)c2)C(=O)c2cc(Cl)cc3cc[nH]c23)cc1
InChIKey
DMEJNFVXPDAAOI-UHFFFAOYSA-N
Molecular formula
C29H28ClF3N2O
Average molar mass
513 g/mol

Names & identifiers

Preferred name
5-Chloro-1H-indole-7-carboxylic acid (4-tert-butyl-benzyl)-[2-(3-trifluoromethyl-phenyl)-ethyl]-amide
IUPAC
N-[(4-tert-butylphenyl)methyl]-5-chloro-N-[2-[3-(trifluoromethyl)phenyl]ethyl]-1H-indole-7-carboxamide

Names & synonyms

5-Chloro-1H-indole-7-carboxylic acid (4-tert-butyl-benzyl)-[2-(3-trifluoromethyl-phenyl)-ethyl]-amideSCHEMBL1385185

Database identifiers

PubChem CID
11670740

Properties

Computed structural properties

XLogP
8.1
Topological polar surface area
36.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
36

Related reactions

2 records
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Compound notes

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