1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1H-1,2,4-triazol-3-ylsulfanyl)ethanone
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone
Also Known As: CBKinase1_008243|CBKinase1_020643|SDCCGMLS-0022931.P002|VU0174616-6|1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1H-1,2,4-triazol-3-ylsulfanyl)ethanone|F3394-1172|AP-853/42502636|SR-01000281887-1|BRD-K33386083-001-01-7|1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1H-1,2,4-triazol-3-ylsulfanyl)ethan-1-one|1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone|A4101/0174848|2-((1H-1,2,4-triazol-3-yl)thio)-1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ethanone|1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1H-1,2,4-triazol-3-ylthio)-1-ethanone|1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1H-1,2,4-triazol-3-ylthio)ethanone|1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)ethanone|1-(2H,3H-benzo[3,4-e]1,4-dioxan-6-yl)-2-(4H-1,2,4-triazol-3-ylthio)ethan-1-one|1-Ethanone, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4H-1,2,4-triazol-3-ylthio)-|2-((1H-1,2,4-triazol-3-yl)thio)-1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ethan-1-one|1-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-2-(4H-1,2,4-TRIAZOL-3-YLSULFANYL)ETHAN-1-ONE
| Molecular Formula | C12H11N3O3S |
|---|---|
| Molecular Weight | 277.05212 g/mol |
| LogP | 1.5509 |
| Topological Polar Surface Area | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.05212 |
| Monoisotopic Mass | 277.05212 |
| Heavy Atoms | 19 |
| Complexity | 585.91046 |
Chemical Identifiers
| CAS Number | 690646-70-9 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C(=O)CSC3=NC=NN3 |
Product Overview
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1H-1,2,4-triazol-3-ylsulfanyl)ethanone (CAS 690646-70-9), with molecular formula C12H11N3O3S and molecular weight 277.05212 g/mol. IUPAC: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone.