1-(6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-5-bromo-2,3-dihydro-1H-indol-1-yl)propan-1-one
Chemical Structure Depiction of
1-(6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-5-bromo-2,3-dihydro-1H-indol-1-yl)propan-1-one
1-(6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-5-bromo-2,3-dihydro-1H-indol-1-yl)propan-1-one
Compound characteristics
| Compound ID: | C137-1422 |
| Compound Name: | 1-(6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-5-bromo-2,3-dihydro-1H-indol-1-yl)propan-1-one |
| Molecular Weight: | 536.44 |
| Molecular Formula: | C23 H26 Br N3 O5 S |
| Smiles: | CCC(N1CCc2cc(c(cc12)S(N1CCN(CC1)Cc1ccc2c(c1)OCO2)(=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2487 |
| logD: | 3.1535 |
| logSw: | -3.5151 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 68.028 |
| InChI Key: | FIHYEORHNYJWME-UHFFFAOYSA-N |