3-Oxo-2-quinoxalin-2-yl-1,2,3,4,6,7-hexahydro-pyrazolo[4,3-c]pyridine-5-carboxylic acid tert-butyl ester

HCID 69734185
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Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCc2[nH]n(-c3cnc4ccccc4n3)c(=O)c2C1
InChIKey
ZQQLETXYWFDEDK-UHFFFAOYSA-N
Molecular formula
C19H21N5O3
Average molar mass
367.4 g/mol

Names & identifiers

Preferred name
3-Oxo-2-quinoxalin-2-yl-1,2,3,4,6,7-hexahydro-pyrazolo[4,3-c]pyridine-5-carboxylic acid tert-butyl ester
IUPAC
tert-butyl 3-oxo-2-quinoxalin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxylate

Names & synonyms

SCHEMBL6293337ZQQLETXYWFDEDK-UHFFFAOYSA-N3-Oxo-2-quinoxalin-2-yl-1,2,3,4,6,7-hexahydro-pyrazolo[4,3-c]pyridine-5-carboxylic acid tert-butyl ester

Database identifiers

PubChem CID
69734185

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
87.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
27

Related reactions

11 records
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Compound notes

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