N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-4-methylbenzamide
Chemical Structure Depiction of
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-4-methylbenzamide
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-4-methylbenzamide
Compound characteristics
| Compound ID: | Y030-4988 |
| Compound Name: | N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-4-methylbenzamide |
| Molecular Weight: | 346.42 |
| Molecular Formula: | C16 H14 N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)C(Nc1nc2ccc(cc2s1)S(C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.999 |
| logD: | 2.9924 |
| logSw: | -3.4859 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.84 |
| InChI Key: | AOTHJQYZBACJJZ-UHFFFAOYSA-N |