methyl 5-methyl-1,1-dioxo-2-{2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Chemical Structure Depiction of
methyl 5-methyl-1,1-dioxo-2-{2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
methyl 5-methyl-1,1-dioxo-2-{2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Compound characteristics
| Compound ID: | S342-0866 |
| Compound Name: | methyl 5-methyl-1,1-dioxo-2-{2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate |
| Molecular Weight: | 405.35 |
| Molecular Formula: | C15 H14 F3 N3 O5 S |
| Smiles: | CC1C(=CN(CC(Nc2ccccc2C(F)(F)F)=O)S(N=1)(=O)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.1916 |
| logD: | 1.1916 |
| logSw: | -2.4844 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.124 |
| InChI Key: | BFGHEGOIAGYEEE-UHFFFAOYSA-N |