N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-2,2-dimethylpropanamide
Chemical Structure Depiction of
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-2,2-dimethylpropanamide
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-2,2-dimethylpropanamide
Compound characteristics
| Compound ID: | Y030-6452 |
| Compound Name: | N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-2,2-dimethylpropanamide |
| Molecular Weight: | 312.41 |
| Molecular Formula: | C13 H16 N2 O3 S2 |
| Smiles: | CC(C)(C)C(Nc1nc2ccc(cc2s1)S(C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1667 |
| logD: | 2.1661 |
| logSw: | -3.0244 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.111 |
| InChI Key: | VLXYNOOSSPBLQH-UHFFFAOYSA-N |