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

HCID 16062575
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Basic information

Standard SMILES
CC(C)Oc1ccccc1C1CCN(C(=O)c2cn(CC(=O)N3CCN(C)CC3)c3cc(Cl)ccc23)CC1
InChIKey
YRZOROXSDFRPBV-UHFFFAOYSA-N
Molecular formula
C30H37ClN4O3
Average molar mass
537.1 g/mol

Names & identifiers

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

Names & synonyms

SCHEMBL614916YRZOROXSDFRPBV-UHFFFAOYSA-N2-{6-Chloro-3-[4-(2-isopropoxy-phenyl)-piperidine-1-carbonyl]-indol-1-yl}-1-(4-methyl-piperazin-1-yl)-ethanone

Database identifiers

PubChem CID
16062575

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
58 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
38

Related reactions

2 records
New reaction record

Linked notes

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