887375-67-9
4-fluoro-5-[[(2S)-2-methyl-1,4-diazepan-1-yl]sulfonyl]isoquinoline;dihydrate;hydrochloride
Molecular Identity
887375-67-9
4-fluoro-5-[[(2S)-2-methyl-1,4-diazepan-1-yl]sulfonyl]isoquinoline;dihydrate;hydrochloride
PubChem CID: 11625386
2D Structure
Properties
C15H23ClFN3O4S
Molecular Formula
395.90
Molecular Weight
g/mol
395.1082
Exact Mass
Da
72.7
TPSA
Good oral absorption (< 140 A²)
4
H-Bond Donors
8
H-Bond Acceptors
482
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
887375-67-9Ripasudil hydrochloride dihydrateK-115glanatecRipasudil hydrochloride hydrateripasudil hydrochloride016TTR32QFK-115-RK-3211H-1,4-Diazepine, 1-((4-fluoro-5-isoquinolinyl)sulfonyl)hexahydro-2-methyl-, monohydrochloride, dihydrate, (2S)-Isoquinoline, 4-fluoro-5-(((2S)-hexahydro-2-methyl-1H-1,4-diazepin-1-yl)sulfonyl)-, hydrochloride, hydrate (1:1:2)1H-1,4-Diazepine, 1-[(4-fluoro-5-isoquinolinyl)sulfonyl]hexahydro-2-methyl-, monohydrochloride, dihydrate, (2S)-Isoquinoline, 4-fluoro-5-[[(2S)-hexahydro-2-methyl-1H-1,4-diazepin-1-yl]sulfonyl]-, hydrochloride, hydrate (1:1:2)K115 compoundRefChem:179485
Data from PubChem (NCBI)
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