{3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Chemical Structure Depiction of
{3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
{3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Compound characteristics
| Compound ID: | S342-0451 |
| Compound Name: | {3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate |
| Molecular Weight: | 446.36 |
| Molecular Formula: | C16 H13 F3 N4 O6 S |
| Smiles: | CC1C(=CN(C)S(N=1)(=O)=O)C(=O)OCc1nc(c2ccc(cc2)OC(F)(F)F)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.6273 |
| logD: | 2.6273 |
| logSw: | -2.9692 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 101.862 |
| InChI Key: | FEXUXDPZZNARHN-UHFFFAOYSA-N |