N-{2-[(adamantan-1-yl)oxy]ethyl}-3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-{2-[(adamantan-1-yl)oxy]ethyl}-3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
N-{2-[(adamantan-1-yl)oxy]ethyl}-3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | 8016-0928 |
| Compound Name: | N-{2-[(adamantan-1-yl)oxy]ethyl}-3-methyl-2-oxo-2,3-dihydro-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 422.56 |
| Molecular Formula: | C20 H26 N2 O4 S2 |
| Smiles: | CN1C(=O)Sc2cc(ccc12)S(NCCOC12CC3CC(CC(C3)C2)C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5412 |
| logD: | 4.5411 |
| logSw: | -4.3247 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.709 |
| InChI Key: | ZRUUFOOLXAXCFA-UHFFFAOYSA-N |