N-(2-methoxy-4-nitrophenyl)-4-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-4-nitrophenyl)-4-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]piperazine-1-carboxamide
N-(2-methoxy-4-nitrophenyl)-4-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | G851-0827 |
| Compound Name: | N-(2-methoxy-4-nitrophenyl)-4-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 452.47 |
| Molecular Formula: | C22 H24 N6 O5 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(Nc1ccc(cc1OC)[N+]([O-])=O)=O)c1nc(C)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.4329 |
| logD: | 4.4225 |
| logSw: | -4.3679 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.886 |
| InChI Key: | KHPFCCDWZSHEGC-UHFFFAOYSA-N |