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N-pyridin-3-yl-5-thiophen-3-yl-2,3-dihydroindole-1-carboxamide

HCID 18940917
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
O=C(Nc1cccnc1)N1CCc2cc(-c3ccsc3)ccc21
InChIKey
KIAWWMDXYYZGJQ-UHFFFAOYSA-N
Molecular formula
C18H15N3OS
Average molar mass
321.4 g/mol
Monoisotopic mass
321.09358328

Names & identifiers

Preferred name
N-pyridin-3-yl-5-thiophen-3-yl-2,3-dihydroindole-1-carboxamide
IUPAC
N-pyridin-3-yl-5-thiophen-3-yl-2,3-dihydroindole-1-carboxamide

Names & synonyms

SCHEMBL8529942

Database identifiers

PubChem CID
18940917

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
73.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
23
Formal charge
0
Complexity
432

Related reactions

1 records
New reaction record
HRID 113004 reaction equation
HRID 113004As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

Compound notes

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