5-bromo-N-[3-(methylsulfanyl)phenyl]-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonamide
Chemical Structure Depiction of
5-bromo-N-[3-(methylsulfanyl)phenyl]-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonamide
5-bromo-N-[3-(methylsulfanyl)phenyl]-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonamide
Compound characteristics
| Compound ID: | C137-2011 |
| Compound Name: | 5-bromo-N-[3-(methylsulfanyl)phenyl]-1-propanoyl-2,3-dihydro-1H-indole-6-sulfonamide |
| Molecular Weight: | 455.39 |
| Molecular Formula: | C18 H19 Br N2 O3 S2 |
| Smiles: | CCC(N1CCc2cc(c(cc12)S(Nc1cccc(c1)SC)(=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0873 |
| logD: | 4.0504 |
| logSw: | -4.0895 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.311 |
| InChI Key: | DRUDEQWUDQGKIU-UHFFFAOYSA-N |