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

HCID 59619741
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Basic information

Standard SMILES
Cc1nn(C(C)C)cc1-n1c(=O)n(C)c2cnc3ccc(B4OC(C)(C)C(C)(C)O4)cc3c21
InChIKey
SSKLMMZZVAFSLO-UHFFFAOYSA-N
Molecular formula
C24H30BN5O3
Average molar mass
447.3 g/mol

Names & identifiers

Preferred name
1-(1-isopropyl-3-methyl-1H-pyrazol-4-yl)-3-methyl-8-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1,3-dihydro-imidazo[4,5-c]quinolin-2-one
IUPAC
3-methyl-1-(3-methyl-1-propan-2-ylpyrazol-4-yl)-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[4,5-c]quinolin-2-one

Names & synonyms

SCHEMBL2068056SSKLMMZZVAFSLO-UHFFFAOYSA-N1-(1-isopropyl-3-methyl-1H-pyrazol-4-yl)-3-methyl-8-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1,3-dihydro-imidazo[4,5-c]quinolin-2-one

Database identifiers

PubChem CID
59619741

Properties

Computed structural properties

Topological polar surface area
72.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
33

Related reactions

2 records
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Compound notes

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