ethyl 4-({3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carbonyl}amino)piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-({3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carbonyl}amino)piperidine-1-carboxylate
ethyl 4-({3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carbonyl}amino)piperidine-1-carboxylate
Compound characteristics
| Compound ID: | F486-1134 |
| Compound Name: | ethyl 4-({3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carbonyl}amino)piperidine-1-carboxylate |
| Molecular Weight: | 483.48 |
| Molecular Formula: | C22 H25 N7 O6 |
| Smiles: | CCOC(N1CCC(CC1)NC(c1nc(C2C(N(C)C(N(c3ccc(C)cc3)N=2)=O)=O)no1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1763 |
| logD: | 2.1763 |
| logSw: | -2.6466 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 120.878 |
| InChI Key: | CXSOFZKNRRQPNF-UHFFFAOYSA-N |