3-{3-[2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-[(2-fluorophenyl)methyl]propanamide
Chemical Structure Depiction of
3-{3-[2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-[(2-fluorophenyl)methyl]propanamide
3-{3-[2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-[(2-fluorophenyl)methyl]propanamide
Compound characteristics
| Compound ID: | F506-0969 |
| Compound Name: | 3-{3-[2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-[(2-fluorophenyl)methyl]propanamide |
| Molecular Weight: | 484.87 |
| Molecular Formula: | C22 H18 Cl F N6 O4 |
| Smiles: | CN1C(C(c2nc(CCC(NCc3ccccc3F)=O)on2)=NN(C1=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4552 |
| logD: | 3.4552 |
| logSw: | -4.0242 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.825 |
| InChI Key: | RYDCDKGFBVMYSE-UHFFFAOYSA-N |