1-(azepan-1-yl)-3-(5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonyl)propan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-3-(5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonyl)propan-1-one
1-(azepan-1-yl)-3-(5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonyl)propan-1-one
Compound characteristics
| Compound ID: | C183-0065 |
| Compound Name: | 1-(azepan-1-yl)-3-(5-bromo-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonyl)propan-1-one |
| Molecular Weight: | 471.41 |
| Molecular Formula: | C20 H27 Br N2 O4 S |
| Smiles: | CCC(N1CCc2cc(c(cc12)S(CCC(N1CCCCCC1)=O)(=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9075 |
| logD: | 2.9075 |
| logSw: | -3.5216 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.15 |
| InChI Key: | QYDAHQUYEHCOKE-UHFFFAOYSA-N |