6-(3-chloro-4-methoxyphenyl)-3-ethyl-N-(2-fluorophenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
6-(3-chloro-4-methoxyphenyl)-3-ethyl-N-(2-fluorophenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
6-(3-chloro-4-methoxyphenyl)-3-ethyl-N-(2-fluorophenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | D137-0382 |
| Compound Name: | 6-(3-chloro-4-methoxyphenyl)-3-ethyl-N-(2-fluorophenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide |
| Molecular Weight: | 447.92 |
| Molecular Formula: | C20 H19 Cl F N5 O2 S |
| Smiles: | CCc1nnc2n1NC(C(C(Nc1ccccc1F)=O)S2)c1ccc(c(c1)[Cl])OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7831 |
| logD: | 3.7813 |
| logSw: | -4.2933 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.963 |
| InChI Key: | JUBIFOWGGVCDFX-UHFFFAOYSA-N |