N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-3-phenylprop-2-enamide
Chemical Structure Depiction of
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-3-phenylprop-2-enamide
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | 4100-4201 |
| Compound Name: | N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-3-phenylprop-2-enamide |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C17 H14 N2 O3 S2 |
| Smiles: | CS(c1ccc2c(c1)sc(NC(/C=C/c1ccccc1)=O)n2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3359 |
| logD: | 3.3357 |
| logSw: | -3.8038 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.626 |
| InChI Key: | JQXZMJWQWIQLOE-UHFFFAOYSA-N |