3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide
Chemical Structure Depiction of
3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide
3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide
Compound characteristics
| Compound ID: | C300-0171 |
| Compound Name: | 3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide |
| Molecular Weight: | 535.41 |
| Molecular Formula: | C23 H23 Br N2 O6 S |
| Smiles: | C(CS(c1cc2c(CCN2C(C2CC2)=O)cc1[Br])(=O)=O)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3785 |
| logD: | 2.3781 |
| logSw: | -3.1153 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.178 |
| InChI Key: | BOTCLVXKDOCKMH-UHFFFAOYSA-N |