1-(1-{2-[(2H-1,3-benzodioxol-5-yl)oxy]ethyl}-5-bromo-1H-indol-3-yl)-2,2,2-trifluoroethan-1-one
Chemical Structure Depiction of
1-(1-{2-[(2H-1,3-benzodioxol-5-yl)oxy]ethyl}-5-bromo-1H-indol-3-yl)-2,2,2-trifluoroethan-1-one
1-(1-{2-[(2H-1,3-benzodioxol-5-yl)oxy]ethyl}-5-bromo-1H-indol-3-yl)-2,2,2-trifluoroethan-1-one
Compound characteristics
| Compound ID: | 6415-0695 |
| Compound Name: | 1-(1-{2-[(2H-1,3-benzodioxol-5-yl)oxy]ethyl}-5-bromo-1H-indol-3-yl)-2,2,2-trifluoroethan-1-one |
| Molecular Weight: | 456.21 |
| Molecular Formula: | C19 H13 Br F3 N O4 |
| Smiles: | C(COc1ccc2c(c1)OCO2)n1cc(C(C(F)(F)F)=O)c2cc(ccc12)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.0599 |
| logD: | 5.0599 |
| logSw: | -4.8523 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.221 |
| InChI Key: | GBNLULADPUFYJJ-UHFFFAOYSA-N |