4-(3-Hydroxyisoindolin-1-on-2-ylmethylthio)pyridine

HCID 19079166
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Basic information

Standard SMILES
O=C1c2ccccc2C(O)N1CSc1ccncc1
InChIKey
YTFVBYBDZGYCKR-UHFFFAOYSA-N
Molecular formula
C14H12N2O2S
Average molar mass
272.32 g/mol

Names & identifiers

Preferred name
4-(3-Hydroxyisoindolin-1-on-2-ylmethylthio)pyridine
IUPAC
3-hydroxy-2-(pyridin-4-ylsulfanylmethyl)-3H-isoindol-1-one

Names & synonyms

SCHEMBL8615337YTFVBYBDZGYCKR-UHFFFAOYSA-N4-(3-hydroxyisoindolin-1-on-2-ylmethylthio)pyridine4-[(3-hydroxyisoindolin-1-on-2-yl)methylthio]pyridine

Database identifiers

PubChem CID
19079166

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
78.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
19

Related reactions

11 records
New reaction record

Compound notes

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