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Hexahydro-1-(5-isoquinolinylsulfonyl)-1H-1,4-diazepine monohydrochloride
[CAS# 133337-43-6]

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Identification
Name Hexahydro-1-(5-isoquinolinylsulfonyl)-1H-1,4-diazepine monohydrochloride
Synonyms Ha-1077 Dihydrochloride; Mls000069344; Smr000058993
Molecular Structure CAS#: 133337-43-6, Hexahydro-1-(5-isoquinolinylsulfonyl)-1H-1,4-diazepine monohydrochloride
Molecular Formula C14H18ClN3O2S
Molecular Weight 327.83
CAS Registry Number 133337-43-6
SMILES [H+].C2=C([S](=O)(=O)N1CCNCCC1)C3=C(C=C2)C=NC=C3.[Cl-]
InChI 1S/C14H17N3O2S.ClH/c18-20(19,17-9-2-6-15-8-10-17)14-4-1-3-12-11-16-7-5-13(12)14;/h1,3-5,7,11,15H,2,6,8-10H2;1H
InChIKey LFVPBERIVUNMGV-UHFFFAOYSA-N
Properties
Boiling point 506.2°C at 760 mmHg (Cal.)
Flash point 259.9°C (Cal.)
solubility Soluble to 100 mM in water and to 75 mM in DMSO
Market Analysis Reports
List of Reports Available for Hexahydro-1-(5-isoquinolinylsulfonyl)-1H-1,4-diazepine monohydrochloride
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