N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-[4-methyl-2-(4-methylphenyl)-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-[4-methyl-2-(4-methylphenyl)-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-[4-methyl-2-(4-methylphenyl)-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: | F506-0761 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}propanamide |
| Molecular Weight: | 490.47 |
| Molecular Formula: | C24 H22 N6 O6 |
| Smiles: | Cc1ccc(cc1)N1C(N(C)C(C(c2nc(CCC(Nc3ccc4c(c3)OCCO4)=O)on2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1818 |
| logD: | 2.1817 |
| logSw: | -2.9812 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.326 |
| InChI Key: | GHGNQPGXGMVKOI-UHFFFAOYSA-N |