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3-[1-(ethylsulfonyl)-4-piperidinyl]-5-{5-[(2-methyl-1-pyrrolidinyl)methyl]-3-pyridinyl}-1H-indole-7-carboxamide

HCID 57732624
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCS(=O)(=O)N1CCC(c2c[nH]c3c(C(N)=O)cc(-c4cncc(CN5CCCC5C)c4)cc23)CC1
InChIKey
RFUUAXURUGXWRF-UHFFFAOYSA-N
Molecular formula
C27H35N5O3S
Average molar mass
509.7 g/mol

Names & identifiers

Preferred name
3-[1-(ethylsulfonyl)-4-piperidinyl]-5-{5-[(2-methyl-1-pyrrolidinyl)methyl]-3-pyridinyl}-1H-indole-7-carboxamide
IUPAC
3-(1-ethylsulfonylpiperidin-4-yl)-5-[5-[(2-methylpyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indole-7-carboxamide

Names & synonyms

SCHEMBL552068RFUUAXURUGXWRF-UHFFFAOYSA-N3-[1-(ethylsulfonyl)-4-piperidinyl]-5-{5-[(2-methyl-1-pyrrolidinyl)methyl]-3-pyridinyl}-1H-indole-7-carboxamide

Database identifiers

PubChem CID
57732624

Properties

Computed structural propertiesFilling in

XLogP
2.4
Topological polar surface area
121 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
36
Formal charge
0
Complexity
871

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Related reactions

3 records
New reaction record
HRID 562156 reaction equation
HRID 562156As productuspto-grants-2011_11
HRID 817782 reaction equation
HRID 817782As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 1806342 reaction equation
HRID 1806342As productuspto-grants-2013_01

Compound notes

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