1-(3-Phenyl-propyl)-piperidine-4-carboxylic acid {2-oxo-2-[4-(2-trifluoromethyl-benzoyl)-piperazin-1-yl]-ethyl}-amide

HCID 59559677
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Basic information

Standard SMILES
O=C(NCC(=O)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)C1CCN(CCCc2ccccc2)CC1
InChIKey
ZDOWVRLEUSBRPU-UHFFFAOYSA-N
Molecular formula
C29H35F3N4O3
Average molar mass
544.6 g/mol
Monoisotopic mass
544.26612548

Names & identifiers

Preferred name
1-(3-Phenyl-propyl)-piperidine-4-carboxylic acid {2-oxo-2-[4-(2-trifluoromethyl-benzoyl)-piperazin-1-yl]-ethyl}-amide
IUPAC
N-[2-oxo-2-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]ethyl]-1-(3-phenylpropyl)piperidine-4-carboxamide

Names & synonyms

1-(3-Phenyl-propyl)-piperidine-4-carboxylic acid {2-oxo-2-[4-(2-trifluoromethyl-benzoyl)-piperazin-1-yl]-ethyl}-amideSCHEMBL1222178

Database identifiers

PubChem CID
59559677

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
73 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
39

Related reactions

2 records
New reaction record

Compound notes

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