N-[2-(trifluoromethyl)phenyl]-3-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)propanamide
Chemical Structure Depiction of
N-[2-(trifluoromethyl)phenyl]-3-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)propanamide
N-[2-(trifluoromethyl)phenyl]-3-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | 5983-5254 |
| Compound Name: | N-[2-(trifluoromethyl)phenyl]-3-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)propanamide |
| Molecular Weight: | 398.36 |
| Molecular Formula: | C17 H13 F3 N2 O4 S |
| Smiles: | C(CN1C(c2ccccc2S1(=O)=O)=O)C(Nc1ccccc1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9838 |
| logD: | 1.9838 |
| logSw: | -2.8362 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.614 |
| InChI Key: | DMTBRSRPNLUEST-UHFFFAOYSA-N |