4-(2-Fluoro-5-hydroxy-4-methylanilino)-6-methoxy-7-[(1-methylimidazol-2-yl)methoxy]cinnoline hydrochloride

HCID 21991024
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Basic information

Standard SMILES
COc1cc2c(Nc3cc(O)c(C)cc3F)cnnc2cc1OCc1nccn1C.Cl
InChIKey
DJNBUNOSNOMWCA-UHFFFAOYSA-N
Molecular formula
C21H21ClFN5O3
Average molar mass
445.9 g/mol

Names & identifiers

Preferred name
4-(2-Fluoro-5-hydroxy-4-methylanilino)-6-methoxy-7-[(1-methylimidazol-2-yl)methoxy]cinnoline hydrochloride
IUPAC
4-fluoro-5-[[6-methoxy-7-[(1-methylimidazol-2-yl)methoxy]cinnolin-4-yl]amino]-2-methylphenol;hydrochloride

Names & synonyms

SCHEMBL6095905DJNBUNOSNOMWCA-UHFFFAOYSA-N4-(2-fluoro-5-hydroxy-4-methylanilino)-6-methoxy-7-[(1-methylimidazol-2-yl)methoxy]cinnoline hydrochloride

Database identifiers

PubChem CID
21991024

Properties

Computed structural properties

Topological polar surface area
94.3 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
6
Heavy atoms
31

Related reactions

2 records
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Compound notes

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