N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-6-(4-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-6-(4-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-6-(4-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | 7238-1454 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-3-methyl-6-(4-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
| Molecular Weight: | 467.9 |
| Molecular Formula: | C20 H17 Cl F3 N5 O S |
| Smiles: | Cc1ccc(cc1)C1C(C(Nc2cc(ccc2[Cl])C(F)(F)F)=O)Sc2nnc(C)n2N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.548 |
| logD: | 4.2371 |
| logSw: | -4.7403 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.134 |
| InChI Key: | CAVUHGZGHNDMKV-UHFFFAOYSA-N |