1-{4-[1-(3-Chloro-phenyl)-5-(4-isopropyl-piperazine-1-carbonyl)-1H-indole-2-carbonyl]-piperazin-1-yl}-2-methyl-propan-1-one

HCID 68535477
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Basic information

Standard SMILES
CC(C)C(=O)N1CCN(C(=O)c2cc3cc(C(=O)N4CCN(C(C)C)CC4)ccc3n2-c2cccc(Cl)c2)CC1
InChIKey
MSTCSIBNMQDCPV-UHFFFAOYSA-N
Molecular formula
C31H38ClN5O3
Average molar mass
564.1 g/mol

Names & identifiers

Preferred name
1-{4-[1-(3-Chloro-phenyl)-5-(4-isopropyl-piperazine-1-carbonyl)-1H-indole-2-carbonyl]-piperazin-1-yl}-2-methyl-propan-1-one
IUPAC
1-[4-[1-(3-chlorophenyl)-5-(4-propan-2-ylpiperazine-1-carbonyl)indole-2-carbonyl]piperazin-1-yl]-2-methylpropan-1-one

Names & synonyms

SCHEMBL3165642MSTCSIBNMQDCPV-UHFFFAOYSA-N1-{4-[1-(3-Chloro-phenyl)-5-(4-isopropyl-piperazine-1-carbonyl)-1H-indole-2-carbonyl]-piperazin-1-yl}-2-methyl-propan-1-one

Database identifiers

PubChem CID
68535477

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
69.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
40

Related reactions

1 records
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Compound notes

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