3-[(4-tert-butylphenoxy)methyl]-6-[4-(difluoromethoxy)phenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Chemical Structure Depiction of
3-[(4-tert-butylphenoxy)methyl]-6-[4-(difluoromethoxy)phenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
3-[(4-tert-butylphenoxy)methyl]-6-[4-(difluoromethoxy)phenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Compound characteristics
| Compound ID: | 8012-9844 |
| Compound Name: | 3-[(4-tert-butylphenoxy)methyl]-6-[4-(difluoromethoxy)phenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine |
| Molecular Weight: | 444.5 |
| Molecular Formula: | C22 H22 F2 N4 O2 S |
| Smiles: | [H]C(Oc1ccc(cc1)C1CSc2nnc(COc3ccc(cc3)C(C)(C)C)n2N=1)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.2926 |
| logD: | 5.0725 |
| logSw: | -5.3513 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.039 |
| InChI Key: | RYGOQDCDYWTPPR-UHFFFAOYSA-N |