N-[(2,5-dimethoxyphenyl)methyl]-3-(4-methyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[(2,5-dimethoxyphenyl)methyl]-3-(4-methyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-1,2,4-oxadiazole-5-carboxamide
N-[(2,5-dimethoxyphenyl)methyl]-3-(4-methyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | F486-0347 |
| Compound Name: | N-[(2,5-dimethoxyphenyl)methyl]-3-(4-methyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 464.44 |
| Molecular Formula: | C22 H20 N6 O6 |
| Smiles: | [H]c1ccc(cc1)N1C(N(C)C(C(c2nc(C(NCc3cc(ccc3OC)OC)=O)on2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4189 |
| logD: | 2.4188 |
| logSw: | -2.9322 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 113.547 |
| InChI Key: | RKEMYBHFMVTRLE-UHFFFAOYSA-N |