N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}propanamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}propanamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}propanamide
Compound characteristics
| Compound ID: | F506-0477 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}propanamide |
| Molecular Weight: | 494.44 |
| Molecular Formula: | C23 H19 F N6 O6 |
| Smiles: | CN1C(C(c2nc(CCC(Nc3ccc4c(c3)OCCO4)=O)on2)=NN(C1=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7875 |
| logD: | 1.7874 |
| logSw: | -2.5091 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.326 |
| InChI Key: | GHRPUUVEEAUOEL-UHFFFAOYSA-N |