7-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methylidene]-3-methyl-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Chemical Structure Depiction of
7-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methylidene]-3-methyl-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
7-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methylidene]-3-methyl-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Compound characteristics
| Compound ID: | Y502-3865 |
| Compound Name: | 7-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methylidene]-3-methyl-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine |
| Molecular Weight: | 350.44 |
| Molecular Formula: | C18 H18 N6 S |
| Smiles: | CCn1c(C)c(\C=C2/C(c3ccccc3)=Nn3c(C)nnc3S2)cn1 |
| Stereo: | ACHIRAL |
| logP: | 2.5953 |
| logD: | 2.5945 |
| logSw: | -2.5074 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.857 |
| InChI Key: | WAGAFNRBYYUKFD-UHFFFAOYSA-N |