3-(1H-Imidazo[4,5-b]pyridin-2-yl)-5-methoxyphenol

HCID 20184497

Notes Reactions

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Basic information

CAS: 89469-39-6
Standard SMILES: COc1cc(O)cc(-c2nc3ncccc3[nH]2)c1
InChIKey: HJRRKRZLWAUHNJ-UHFFFAOYSA-N
Molecular formula: C13H11N3O2
Average molar mass: 241.24 g/mol
Monoisotopic mass: 241.0851266

Names & identifiers

Preferred name: 3-(1H-Imidazo[4,5-b]pyridin-2-yl)-5-methoxyphenol
IUPAC: 3-(1H-imidazo[4,5-b]pyridin-2-yl)-5-methoxyphenol

Names & synonyms

89469-39-63-(1H-Imidazo[4,5-b]pyridin-2-yl)-5-methoxyphenolSCHEMBL10744129DTXSID40603256HJRRKRZLWAUHNJ-UHFFFAOYSA-N2-(3'-methoxy-5'-hydroxy-phenyl)-imidazo[4,5-b]pyridine

Database identifiers

CAS: 89469-39-6
PubChem CID: 20184497
DTXSID: DTXSID40603256

Properties

Computed structural properties

XLogP: 2.2
Topological polar surface area: 71 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 18
Formal charge: 0
Complexity: 289

Related reactions

3 records

New reaction record

HRID 958693As reactantValidation data from https://doi.org/10.1039/C8SC04228D

HRID 1380729As reactantuspto-grants-1986_04

HRID 2309870As reactantuspto-grants-1987_09

Compound notes

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