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8-bromo-3-methyl-1-(2-methyl-2H-pyrazol-3-yl)-1,3-dihydro-imidazo[4,5-c]quinolin-2-one

HCID 59620095
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Basic information

Standard SMILES
Cn1nccc1-n1c(=O)n(C)c2cnc3ccc(Br)cc3c21
InChIKey
SWUOEWBDAQPHRF-UHFFFAOYSA-N
Molecular formula
C15H12BrN5O
Average molar mass
358.19 g/mol
Monoisotopic mass
357.02252

Names & identifiers

Preferred name
8-bromo-3-methyl-1-(2-methyl-2H-pyrazol-3-yl)-1,3-dihydro-imidazo[4,5-c]quinolin-2-one
IUPAC
8-bromo-3-methyl-1-(2-methylpyrazol-3-yl)imidazo[4,5-c]quinolin-2-one

Names & synonyms

SCHEMBL2067109SWUOEWBDAQPHRF-UHFFFAOYSA-N8-bromo-3-methyl-1-(2-methyl-2H-pyrazol-3-yl)-1,3-dihydro-imidazo[4,5-c]quinolin-2-one

Database identifiers

PubChem CID
59620095

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
54.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
22
Formal charge
0
Complexity
463

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Related reactions

6 records
New reaction record
HRID 211173 reaction equation
HRID 211173As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 445552 reaction equation
HRID 445552As reactantuspto-grants-2013_07
HRID 445555 reaction equation
HRID 445555As reactantuspto-grants-2013_07
HRID 445566 reaction equation
HRID 445566As reactantuspto-grants-2013_07
HRID 1543461 reaction equation
HRID 1543461As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 2143987 reaction equation
HRID 2143987As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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