6-Cyclopropylmethoxy-2-{3-fluoro-4-[7-(2-hydroxy-2-methyl-propyl)-2,7-diaza-spiro[4.4]non-2-yl]-phenyl}-2H-isoquinolin-1-one

HCID 57916632
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Basic information

Standard SMILES
CC(C)(O)CN1CCC2(CCN(c3ccc(-n4ccc5cc(OCC6CC6)ccc5c4=O)cc3F)C2)C1
InChIKey
IFGOVCZFFMCGIZ-UHFFFAOYSA-N
Molecular formula
C30H36FN3O3
Average molar mass
505.6 g/mol

Names & identifiers

Preferred name
6-Cyclopropylmethoxy-2-{3-fluoro-4-[7-(2-hydroxy-2-methyl-propyl)-2,7-diaza-spiro[4.4]non-2-yl]-phenyl}-2H-isoquinolin-1-one
IUPAC
6-(cyclopropylmethoxy)-2-[3-fluoro-4-[7-(2-hydroxy-2-methylpropyl)-2,7-diazaspiro[4.4]nonan-2-yl]phenyl]isoquinolin-1-one

Names & synonyms

SCHEMBL4296142IFGOVCZFFMCGIZ-UHFFFAOYSA-N6-Cyclopropylmethoxy-2-{3-fluoro-4-[7-(2-hydroxy-2-methyl-propyl)-2,7-diaza-spiro[4.4]non-2-yl]-phenyl}-2H-isoquinolin-1-one

Database identifiers

PubChem CID
57916632

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
56.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
37

Related reactions

1 records
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Linked notes

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