3-[chloro(difluoro)methyl]-7-[(1-methyl-1H-pyrazol-3-yl)methylidene]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Chemical Structure Depiction of
3-[chloro(difluoro)methyl]-7-[(1-methyl-1H-pyrazol-3-yl)methylidene]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
3-[chloro(difluoro)methyl]-7-[(1-methyl-1H-pyrazol-3-yl)methylidene]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Compound characteristics
| Compound ID: | Y502-0238 |
| Compound Name: | 3-[chloro(difluoro)methyl]-7-[(1-methyl-1H-pyrazol-3-yl)methylidene]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine |
| Molecular Weight: | 392.82 |
| Molecular Formula: | C16 H11 Cl F2 N6 S |
| Smiles: | Cn1ccc(\C=C2/C(c3ccccc3)=Nn3c(C(F)(F)[Cl])nnc3S2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3265 |
| logD: | 3.3263 |
| logSw: | -3.8426 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.342 |
| InChI Key: | LXMFCYFYLMYZRF-UHFFFAOYSA-N |