6-(4-methoxyphenyl)-3-methyl-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-methoxyphenyl)-3-methyl-N-[3-(trifluoromethyl)phenyl]-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
6-(4-methoxyphenyl)-3-methyl-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: | 7238-1199 |
Compound Name: | 6-(4-methoxyphenyl)-3-methyl-N-[3-(trifluoromethyl)phenyl]-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
Molecular Weight: | 449.45 |
Molecular Formula: | C20 H18 F3 N5 O2 S |
Smiles: | Cc1nnc2n1NC(C(C(Nc1cccc(c1)C(F)(F)F)=O)S2)c1ccc(cc1)OC |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.6267 |
logD: | 3.6208 |
logSw: | -4.0788 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.375 |
InChI Key: | BIDCRGJSUFAJCJ-UHFFFAOYSA-N |