1-(1,3-dimethyl-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 59619623
NotesReactions
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Basic information

Standard SMILES
Cc1nn(C)cc1-n1c(=O)n(C)c2cnc3ccc(B4OC(C)(C)C(C)(C)O4)cc3c21
InChIKey
FVMRZQIDQIINDC-UHFFFAOYSA-N
Molecular formula
C22H26BN5O3
Average molar mass
419.3 g/mol

Names & identifiers

Preferred name
1-(1,3-dimethyl-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
1-(1,3-dimethylpyrazol-4-yl)-3-methyl-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[4,5-c]quinolin-2-one

Names & synonyms

SCHEMBL3513953FVMRZQIDQIINDC-UHFFFAOYSA-N1-(1,3-dimethyl-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
59619623

Properties

Computed structural properties

Topological polar surface area
72.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
31

Related reactions

3 records
New reaction record

Compound notes

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1-(1,3-dimethyl-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 59619623)｜Huagongshe