3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide
Chemical Structure Depiction of
3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide
3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | C300-0034 |
| Compound Name: | 3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide |
| Molecular Weight: | 578.5 |
| Molecular Formula: | C24 H24 Br N3 O5 S2 |
| Smiles: | CCOc1ccc2c(c1)sc(NC(CCS(c1cc3c(CCN3C(C3CC3)=O)cc1[Br])(=O)=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.6197 |
| logD: | 4.6195 |
| logSw: | -4.3515 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.24 |
| InChI Key: | NTSIRBJJHAURNF-UHFFFAOYSA-N |