ethyl 1-{3-[4-ethyl-2-(4-fluorophenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carbonyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{3-[4-ethyl-2-(4-fluorophenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carbonyl}piperidine-4-carboxylate
ethyl 1-{3-[4-ethyl-2-(4-fluorophenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carbonyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | F486-0469 |
| Compound Name: | ethyl 1-{3-[4-ethyl-2-(4-fluorophenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carbonyl}piperidine-4-carboxylate |
| Molecular Weight: | 486.46 |
| Molecular Formula: | C22 H23 F N6 O6 |
| Smiles: | CCN1C(C(c2nc(C(N3CCC(CC3)C(=O)OCC)=O)on2)=NN(C1=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0874 |
| logD: | 2.0874 |
| logSw: | -2.4485 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 111.321 |
| InChI Key: | SGAODVRGYFJFNL-UHFFFAOYSA-N |