ChemDiv1_001503
3-butylsulfanylspiro[7H-[1,2,4]triazino[5,6-d][3,1]benzoxazepine-6,1'-cyclohexane]
Also Known As: ChemDiv1_001503|HMS591E07|AK-968/36944059|SR-01000412919-1|3'-(butylsulfanyl)-6',7'-dihydrospiro(cyclohexane-1,6'-[1,2,4]triazino[5,6-d][3,1]benzoxazepine)|3'-(butylthio)-7'H-spiro[cyclohexane-1,6'-[1,2,4]triazino[5,6-d][3,1]benzoxazepine]|3-butylsulfanylspiro[7H-[1,2,4]triazino[5,6-d][3,1]benzoxazepine-6,1'-cyclohexane]
CAS: 328271-71-2
| Molecular Formula | C19H24N4OS |
|---|---|
| Molecular Weight | 356.16708 g/mol |
| LogP | 4.8955 |
| Topological Polar Surface Area | 59.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.16708 |
| Monoisotopic Mass | 356.16708 |
| Heavy Atoms | 25 |
| Complexity | 745.954 |
Chemical Identifiers
| CAS Number | 328271-71-2 |
|---|---|
| SMILES | CCCCSC1=NC2=C(C3=CC=CC=C3NC4(O2)CCCCC4)N=N1 |
Product Overview
ChemDiv1_001503 (CAS 328271-71-2), with molecular formula C19H24N4OS and molecular weight 356.16708 g/mol. IUPAC: 3-butylsulfanylspiro[7H-[1,2,4]triazino[5,6-d][3,1]benzoxazepine-6,1'-cyclohexane].
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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