1-(azepan-1-yl)-3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]propan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]propan-1-one
1-(azepan-1-yl)-3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]propan-1-one
Compound characteristics
| Compound ID: | C300-0080 |
| Compound Name: | 1-(azepan-1-yl)-3-[5-bromo-1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-6-sulfonyl]propan-1-one |
| Molecular Weight: | 483.42 |
| Molecular Formula: | C21 H27 Br N2 O4 S |
| Smiles: | C1CCCN(CC1)C(CCS(c1cc2c(CCN2C(C2CC2)=O)cc1[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0849 |
| logD: | 3.0849 |
| logSw: | -3.5675 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.929 |
| InChI Key: | VJWHNPKDONIZSP-UHFFFAOYSA-N |