N-(3-chloro-4-fluorophenyl)-3,6-diphenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-3,6-diphenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
N-(3-chloro-4-fluorophenyl)-3,6-diphenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | 7238-1521 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-3,6-diphenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
| Molecular Weight: | 465.94 |
| Molecular Formula: | C23 H17 Cl F N5 O S |
| Smiles: | c1ccc(cc1)C1C(C(Nc2ccc(c(c2)[Cl])F)=O)Sc2nnc(c3ccccc3)n2N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2668 |
| logD: | 5.1686 |
| logSw: | -6.0182 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.783 |
| InChI Key: | VPYUVBZONUAIGD-UHFFFAOYSA-N |