3-[chloro(difluoro)methyl]-7-[(5-methylthiophen-2-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-[(5-methylthiophen-2-yl)methylidene]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
3-[chloro(difluoro)methyl]-7-[(5-methylthiophen-2-yl)methylidene]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Compound characteristics
| Compound ID: | Y501-9757 |
| Compound Name: | 3-[chloro(difluoro)methyl]-7-[(5-methylthiophen-2-yl)methylidene]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine |
| Molecular Weight: | 408.88 |
| Molecular Formula: | C17 H11 Cl F2 N4 S2 |
| Smiles: | Cc1ccc(/C=C2/C(c3ccccc3)=Nn3c(C(F)(F)[Cl])nnc3S2)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.4959 |
| logD: | 5.4951 |
| logSw: | -6.1481 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.174 |
| InChI Key: | IOTCBURNFXOKNK-UHFFFAOYSA-N |