6-(4-methylphenyl)-3-propyl-N-[3-(trifluoromethyl)phenyl]-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
6-(4-methylphenyl)-3-propyl-N-[3-(trifluoromethyl)phenyl]-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
6-(4-methylphenyl)-3-propyl-N-[3-(trifluoromethyl)phenyl]-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | D137-0440 |
| Compound Name: | 6-(4-methylphenyl)-3-propyl-N-[3-(trifluoromethyl)phenyl]-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
| Molecular Weight: | 461.51 |
| Molecular Formula: | C22 H22 F3 N5 O S |
| Smiles: | CCCc1nnc2n1NC(C(C(Nc1cccc(c1)C(F)(F)F)=O)S2)c1ccc(C)cc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2452 |
| logD: | 5.2394 |
| logSw: | -5.0676 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.031 |
| InChI Key: | QPMMUNAGXKKOPD-UHFFFAOYSA-N |