AC1O4PDC
6-(4-bromophenyl)-3-butylsulfanyl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Also Known As: AK-968/36944046|SR-01000412920-1|6-(4-bromophenyl)-3-(butylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine|6-(4-bromophenyl)-3-butylsulfanyl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
CAS: 328271-72-3
| Molecular Formula | C20H19BrN4OS |
|---|---|
| Molecular Weight | 442.0463 g/mol |
| LogP | 5.6964 |
| Topological Polar Surface Area | 59.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 442.0463 |
| Monoisotopic Mass | 442.0463 |
| Heavy Atoms | 27 |
| Complexity | 935.5198 |
Chemical Identifiers
| CAS Number | 328271-72-3 |
|---|---|
| SMILES | CCCCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=CC=C(C=C4)Br)N=N1 |
Product Overview
AC1O4PDC (CAS 328271-72-3), with molecular formula C20H19BrN4OS and molecular weight 442.0463 g/mol. IUPAC: 6-(4-bromophenyl)-3-butylsulfanyl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine.
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.
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