5-(5-{[cyclopentyl(methyl)amino]methyl}-3-thienyl)-3-{1-[(1-methylethyl)sulfonyl]-4-piperidinyl}-1H-indole-7-carboxamide

HCID 57732829
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Basic information

Standard SMILES
CC(C)S(=O)(=O)N1CCC(c2c[nH]c3c(C(N)=O)cc(-c4csc(CN(C)C5CCCC5)c4)cc23)CC1
InChIKey
NDVNJKAQIKMZPP-UHFFFAOYSA-N
Molecular formula
C28H38N4O3S2
Average molar mass
542.8 g/mol

Names & identifiers

Preferred name
5-(5-{[cyclopentyl(methyl)amino]methyl}-3-thienyl)-3-{1-[(1-methylethyl)sulfonyl]-4-piperidinyl}-1H-indole-7-carboxamide
IUPAC
5-[5-[[cyclopentyl(methyl)amino]methyl]thiophen-3-yl]-3-(1-propan-2-ylsulfonylpiperidin-4-yl)-1H-indole-7-carboxamide

Names & synonyms

SCHEMBL551848NDVNJKAQIKMZPP-UHFFFAOYSA-N5-(5-{[cyclopentyl(methyl)amino]methyl}-3-thienyl)-3-{1-[(1-methylethyl)sulfonyl]-4-piperidinyl}-1H-indole-7-carboxamide

Database identifiers

PubChem CID
57732829

Properties

Computed structural properties

XLogP
4
Topological polar surface area
136 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
37

Related reactions

2 records
New reaction record

Compound notes

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