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

HCID 59619641
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Basic information

Standard SMILES
Cc1nn(C)cc1-n1c(=O)n(C)c2cnc3ccc(-c4cncc(S(C)(=O)=O)c4)cc3c21
InChIKey
TXPSDQNYXFUVPQ-UHFFFAOYSA-N
Molecular formula
C22H20N6O3S
Average molar mass
448.5 g/mol

Names & identifiers

Preferred name
1-(1,3-Dimethyl-1H-pyrazol-4-yl)-8-(5-methanesulfonyl-pyridin-3-yl)-3-methyl-1,3-dihydro-imidazo[4,5-c]quinolin-2-one
IUPAC
1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(5-methylsulfonyl-3-pyridinyl)imidazo[4,5-c]quinolin-2-one

Names & synonyms

SCHEMBL3516568TXPSDQNYXFUVPQ-UHFFFAOYSA-N1-(1,3-Dimethyl-1H-pyrazol-4-yl)-8-(5-methanesulfonyl-pyridin-3-yl)-3-methyl-1,3-dihydro-imidazo[4,5-c]quinolin-2-one

Database identifiers

PubChem CID
59619641

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
110 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
32

Related reactions

2 records
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Linked notes

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