AC1MFKOS
10-bromo-3-ethylsulfanyl-6-pyridin-3-yl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Also Known As: Oprea1_460095|AN-655/13943023|SR-01000502899-1|10-bromo-3-ethylsulfanyl-6-pyridin-3-yl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine|10-bromo-6-(3-pyridinyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-3-yl ethyl sulfide|10-bromo-3-(ethylsulfanyl)-6-(3-pyridyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
| Molecular Formula | C17H14BrN5OS |
|---|---|
| Molecular Weight | 415.01025 g/mol |
| LogP | 4.3112 |
| Topological Polar Surface Area | 72.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 415.01025 |
| Monoisotopic Mass | 415.01025 |
| Heavy Atoms | 25 |
| Complexity | 908.795 |
Chemical Identifiers
| CAS Number | 354776-74-2 |
|---|---|
| SMILES | CCSC1=NC2=C(C3=C(C=CC(=C3)Br)NC(O2)C4=CN=CC=C4)N=N1 |
Product Overview
AC1MFKOS (CAS 354776-74-2), with molecular formula C17H14BrN5OS and molecular weight 415.01025 g/mol. IUPAC: 10-bromo-3-ethylsulfanyl-6-pyridin-3-yl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine.
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