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8-(5-Amino-6-methoxy-pyridin-3-yl)-1-(1,3-dimethyl-1H-pyrazol-4-yl)-3-methyl-1,3-dihydro-imidazo[4,5-c]quinolin-2-one

HCID 59620033
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
COc1ncc(-c2ccc3ncc4c(c3c2)n(-c2cn(C)nc2C)c(=O)n4C)cc1N
InChIKey
MUJODELDYUKCJH-UHFFFAOYSA-N
Molecular formula
C22H21N7O2
Average molar mass
415.4 g/mol

Names & identifiers

Preferred name
8-(5-Amino-6-methoxy-pyridin-3-yl)-1-(1,3-dimethyl-1H-pyrazol-4-yl)-3-methyl-1,3-dihydro-imidazo[4,5-c]quinolin-2-one
IUPAC
8-(5-amino-6-methoxy-3-pyridinyl)-1-(1,3-dimethylpyrazol-4-yl)-3-methylimidazo[4,5-c]quinolin-2-one

Names & synonyms

SCHEMBL3515141MUJODELDYUKCJH-UHFFFAOYSA-N8-(5-Amino-6-methoxy-pyridin-3-yl)-1-(1,3-dimethyl-1H-pyrazol-4-yl)-3-methyl-1,3-dihydro-imidazo[4,5-c]quinolin-2-one

Database identifiers

PubChem CID
59620033

Properties

Computed structural propertiesFilling in

XLogP
1.6
Topological polar surface area
102 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
31
Formal charge
0
Complexity
680

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Related reactions

2 records
New reaction record
HRID 445685 reaction equation
HRID 445685As productuspto-grants-2013_07
HRID 2135594 reaction equation
HRID 2135594As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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