N-[(3-bromophenyl)methyl]-3-ethyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-3-ethyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
N-[(3-bromophenyl)methyl]-3-ethyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | F818-1128 |
| Compound Name: | N-[(3-bromophenyl)methyl]-3-ethyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 427.34 |
| Molecular Formula: | C16 H15 Br N2 O3 S2 |
| Smiles: | CCN1C(=O)Sc2cc(ccc12)S(NCc1cccc(c1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.357 |
| logD: | 4.3566 |
| logSw: | -4.296 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.566 |
| InChI Key: | JOUCGEVXTNGTBL-UHFFFAOYSA-N |