3-[4-ethyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-N-[1-(morpholin-4-yl)butan-2-yl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
3-[4-ethyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-N-[1-(morpholin-4-yl)butan-2-yl]-1,2,4-oxadiazole-5-carboxamide
3-[4-ethyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-N-[1-(morpholin-4-yl)butan-2-yl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | F486-1002 |
| Compound Name: | 3-[4-ethyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-N-[1-(morpholin-4-yl)butan-2-yl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 483.53 |
| Molecular Formula: | C23 H29 N7 O5 |
| Smiles: | CCC(CN1CCOCC1)NC(c1nc(C2C(N(CC)C(N(c3ccc(C)cc3)N=2)=O)=O)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2013 |
| logD: | 2.144 |
| logSw: | -2.6162 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.153 |
| InChI Key: | CVDBLDICKKNKON-INIZCTEOSA-N |