5-{4-(3-Methylimidazo[5,4-b]pyridin-2-ylmethoxy)-benzyl}thiazolidine-2,4-dione

HCID 9799400

Notes Reactions

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Basic information

Standard SMILES: Cn1c(COc2ccc(CC3SC(=O)NC3=O)cc2)nc2cccnc21
InChIKey: VJRCELWLZGOZTR-UHFFFAOYSA-N
Molecular formula: C18H16N4O3S
Average molar mass: 368.4 g/mol
Monoisotopic mass: 368.09431156

Names & identifiers

Preferred name: 5-{4-(3-Methylimidazo[5,4-b]pyridin-2-ylmethoxy)-benzyl}thiazolidine-2,4-dione
IUPAC: 5-[[4-[(3-methylimidazo[4,5-b]pyridin-2-yl)methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione

Names & synonyms

CHEMBL321755SCHEMBL6903005VJRCELWLZGOZTR-UHFFFAOYSA-N5-{4-(3-Methyl-3H-imidazo[4,5-b]pyridin-2-ylmethoxy)benzyl}thiazolidine-2,4-dione5-{4-(3-Methylimidazo[5,4-b]pyridin-2-ylmethoxy)-benzyl}thiazolidine-2,4-dione

Database identifiers

PubChem CID: 9799400
ChEMBL: CHEMBL321755
Nikkaji: J1.381.828B

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 111 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 5
Heavy atoms: 26
Formal charge: 0
Complexity: 541

Related reactions

5 records

New reaction record

HRID 143400As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 1599223As productuspto-grants-1998_04

HRID 1601766As productuspto-grants-1999_11

HRID 1738167As productuspto-grants-1999_10

HRID 1953645As productuspto-grants-2000_09

Compound notes

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