N-(4-((4-(1H-Indol-3-yl)piperidin-1-yl)methyl)thiazol-2-yl)acetamide

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Basic information

Standard SMILES: CC(=O)Nc1nc(CN2CCC(c3c[nH]c4ccccc34)CC2)cs1
InChIKey: DYTSCTCKPLFAQP-UHFFFAOYSA-N
Molecular formula: C19H22N4OS
Average molar mass: 354.5 g/mol

Names & identifiers

Preferred name: N-(4-((4-(1H-Indol-3-yl)piperidin-1-yl)methyl)thiazol-2-yl)acetamide
IUPAC: N-[4-[[4-(1H-indol-3-yl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide

Names & synonyms

N-(4-((4-(1H-Indol-3-yl)piperidin-1-yl)methyl)thiazol-2-yl)acetamide111622-09-4SCHEMBL9834512DYTSCTCKPLFAQP-UHFFFAOYSA-NF865292-acetylamino-4-[4-(3-indolyl)piperidinomethyl]thiazole

Database identifiers

PubChem CID: 14129784
Nikkaji: J601.354F

Properties

Computed structural properties

XLogP: 2.7
Topological polar surface area: 89.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 4
Heavy atoms: 25
Formal charge: 0
Complexity: 468

Related reactions

4 records

New reaction record

HRID 1214519As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

HRID 1252066As productuspto-grants-1988_05

HRID 1252071As reactantuspto-grants-1988_05

HRID 1558221As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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