Irsenontrine
7-(2-methoxy-3,5-dimethyl-4-pyridinyl)-1-[(3S)-oxolan-3-yl]-5H-pyrazolo[4,5-c]quinolin-4-one
Molecular Identity
Irsenontrine
7-(2-methoxy-3,5-dimethyl-4-pyridinyl)-1-[(3S)-oxolan-3-yl]-5H-pyrazolo[4,5-c]quinolin-4-one
PubChem CID: 136253996
2D Structure
Properties
C22H22N4O3
Molecular Formula
390.40
Molecular Weight
g/mol
390.1692
Exact Mass
Da
2.4
XLogP
Drug-like (Lipinski: < 5)
78.3
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
619
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Irsenontrine1429509-82-9Irsenontrine [USAN]E202754QB00NNRBER-592221-00IRSENONTRINE [INN]E-20277-(2-Methoxy-3,5-dimethylpyridin-4-yl)-1-((3S)-tetrahydrofuran-3-yl)-1,5-dihydro-4H-pyrazolo(4,3-c)quinolin-4-oneIrsenontrine (USAN)4H-Pyrazolo(4,3-c)quinolin-4-one, 1,5-dihydro-7-(2-methoxy-3,5-dimethyl-4-pyridinyl)-1-((3S)-tetrahydro-3-furanyl)-RefChem:148865UNII-54QB00NNRB7-(2-methoxy-3,5-dimethylpyridin-4-yl)-1-[(3S)-oxolan-3-yl]-5H-pyrazolo[4,3-c]quinolin-4-oneWHO 11606
Data from PubChem (NCBI)
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