N-[(2,4-dimethoxyphenyl)methyl]-3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[(2,4-dimethoxyphenyl)methyl]-3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carboxamide
N-[(2,4-dimethoxyphenyl)methyl]-3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | F486-0827 |
| Compound Name: | N-[(2,4-dimethoxyphenyl)methyl]-3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 482.43 |
| Molecular Formula: | C22 H19 F N6 O6 |
| Smiles: | CN1C(C(c2nc(C(NCc3ccc(cc3OC)OC)=O)on2)=NN(C1=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5891 |
| logD: | 2.589 |
| logSw: | -3.1278 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 113.547 |
| InChI Key: | PIGFSMVELUXWDX-UHFFFAOYSA-N |