2-{6-Chloro-3-[4-(2-trifluoromethoxy-phenyl)-piperidine-1-carbonyl]-indol-1-yl}-1-(4-methyl-piperazin-1-yl)-ethanone

HCID 16062829
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Basic information

Standard SMILES
CN1CCN(C(=O)Cn2cc(C(=O)N3CCC(c4ccccc4OC(F)(F)F)CC3)c3ccc(Cl)cc32)CC1
InChIKey
ZWDFDWRHRFYCTQ-UHFFFAOYSA-N
Molecular formula
C28H30ClF3N4O3
Average molar mass
563 g/mol
Monoisotopic mass
562.195853

Names & identifiers

Preferred name
2-{6-Chloro-3-[4-(2-trifluoromethoxy-phenyl)-piperidine-1-carbonyl]-indol-1-yl}-1-(4-methyl-piperazin-1-yl)-ethanone
IUPAC
2-[6-chloro-3-[4-[2-(trifluoromethoxy)phenyl]piperidine-1-carbonyl]indol-1-yl]-1-(4-methylpiperazin-1-yl)ethanone

Names & synonyms

2-{6-Chloro-3-[4-(2-trifluoromethoxy-phenyl)-piperidine-1-carbonyl]-indol-1-yl}-1-(4-methyl-piperazin-1-yl)-ethanoneSCHEMBL613022

Database identifiers

PubChem CID
16062829

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
58 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
39

Related reactions

2 records
New reaction record

Compound notes

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