3-(4-ethyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N-[4-(furan-2-yl)butan-2-yl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
3-(4-ethyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N-[4-(furan-2-yl)butan-2-yl]-1,2,4-oxadiazole-5-carboxamide
3-(4-ethyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N-[4-(furan-2-yl)butan-2-yl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | F486-0171 |
| Compound Name: | 3-(4-ethyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N-[4-(furan-2-yl)butan-2-yl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 450.45 |
| Molecular Formula: | C22 H22 N6 O5 |
| Smiles: | [H]c1ccc(cc1)N1C(N(CC)C(C(c2nc(C(NC(C)CCc3ccco3)=O)on2)=N1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7478 |
| logD: | 2.7478 |
| logSw: | -3.1572 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.522 |
| InChI Key: | MPLFTJRXJFFCPK-AWEZNQCLSA-N |