N-cyclohexyl-3-[3-(4-ethyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-1,2,4-oxadiazol-5-yl]-N-methylpropanamide
Chemical Structure Depiction of
N-cyclohexyl-3-[3-(4-ethyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-1,2,4-oxadiazol-5-yl]-N-methylpropanamide
N-cyclohexyl-3-[3-(4-ethyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-1,2,4-oxadiazol-5-yl]-N-methylpropanamide
Compound characteristics
Compound ID: | F506-0022 |
Compound Name: | N-cyclohexyl-3-[3-(4-ethyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-1,2,4-oxadiazol-5-yl]-N-methylpropanamide |
Molecular Weight: | 452.51 |
Molecular Formula: | C23 H28 N6 O4 |
Smiles: | [H]c1ccc(cc1)N1C(N(CC)C(C(c2nc(CCC(N(C)C3CCCCC3)=O)on2)=N1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0439 |
logD: | 3.0439 |
logSw: | -3.1672 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 88.259 |
InChI Key: | NIIZGWFHKNNDAO-UHFFFAOYSA-N |