7-({4-[(3-chlorophenyl)methoxy]-3-ethoxyphenyl}methylidene)-3-(difluoromethyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Chemical Structure Depiction of
7-({4-[(3-chlorophenyl)methoxy]-3-ethoxyphenyl}methylidene)-3-(difluoromethyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
7-({4-[(3-chlorophenyl)methoxy]-3-ethoxyphenyl}methylidene)-3-(difluoromethyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Compound characteristics
| Compound ID: | Y502-2981 |
| Compound Name: | 7-({4-[(3-chlorophenyl)methoxy]-3-ethoxyphenyl}methylidene)-3-(difluoromethyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine |
| Molecular Weight: | 476.93 |
| Molecular Formula: | C22 H19 Cl F2 N4 O2 S |
| Smiles: | CCOc1cc(/C=C2/C(C)=Nn3c(C(F)F)nnc3S2)ccc1OCc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.8808 |
| logD: | 4.8805 |
| logSw: | -5.1253 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.124 |
| InChI Key: | NNXYCPNGIWREFV-UHFFFAOYSA-N |