ethyl 6-(4-chlorophenyl)-3-methyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxylate
Chemical Structure Depiction of
ethyl 6-(4-chlorophenyl)-3-methyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxylate
ethyl 6-(4-chlorophenyl)-3-methyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxylate
Compound characteristics
| Compound ID: | 8016-9188 |
| Compound Name: | ethyl 6-(4-chlorophenyl)-3-methyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxylate |
| Molecular Weight: | 338.81 |
| Molecular Formula: | C14 H15 Cl N4 O2 S |
| Smiles: | [H]N1C(C(C(=O)OCC)Sc2nnc(C)n12)c1ccc(cc1)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5398 |
| logD: | 2.5398 |
| logSw: | -3.5842 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.494 |
| InChI Key: | NYFAYZRICBASMY-UHFFFAOYSA-N |