N-(3,5-dimethylphenyl)-6-(4-fluorophenyl)-3-(phenoxymethyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-6-(4-fluorophenyl)-3-(phenoxymethyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
N-(3,5-dimethylphenyl)-6-(4-fluorophenyl)-3-(phenoxymethyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | D137-0645 |
| Compound Name: | N-(3,5-dimethylphenyl)-6-(4-fluorophenyl)-3-(phenoxymethyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
| Molecular Weight: | 489.57 |
| Molecular Formula: | C26 H24 F N5 O2 S |
| Smiles: | Cc1cc(C)cc(c1)NC(C1C(c2ccc(cc2)F)Nn2c(COc3ccccc3)nnc2S1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7491 |
| logD: | 4.7491 |
| logSw: | -4.4926 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.258 |
| InChI Key: | OESJLTBEJQLPIS-UHFFFAOYSA-N |