N-(3-bromophenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-(3-bromophenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
N-(3-bromophenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | F943-0233 |
| Compound Name: | N-(3-bromophenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 496.4 |
| Molecular Formula: | C19 H18 Br N3 O4 S2 |
| Smiles: | C1CCN(C1)C(CN1C(=O)Sc2cc(ccc12)S(Nc1cccc(c1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8035 |
| logD: | 3.658 |
| logSw: | -4.0054 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.219 |
| InChI Key: | PWVCYMSZELEWNT-UHFFFAOYSA-N |