N-butyl-3-{3-[2-(4-chlorophenyl)-4-ethyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-methylpropanamide
Chemical Structure Depiction of
N-butyl-3-{3-[2-(4-chlorophenyl)-4-ethyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-methylpropanamide
N-butyl-3-{3-[2-(4-chlorophenyl)-4-ethyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-methylpropanamide
Compound characteristics
| Compound ID: | F506-1028 |
| Compound Name: | N-butyl-3-{3-[2-(4-chlorophenyl)-4-ethyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-methylpropanamide |
| Molecular Weight: | 460.92 |
| Molecular Formula: | C21 H25 Cl N6 O4 |
| Smiles: | CCCCN(C)C(CCc1nc(C2C(N(CC)C(N(c3ccc(cc3)[Cl])N=2)=O)=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1623 |
| logD: | 3.1623 |
| logSw: | -3.4535 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 89.457 |
| InChI Key: | FMHLNGBYPYAVFB-UHFFFAOYSA-N |