2-methyl-N-{3-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl}propanamide
Chemical Structure Depiction of
2-methyl-N-{3-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl}propanamide
2-methyl-N-{3-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl}propanamide
Compound characteristics
| Compound ID: | Y032-3054 |
| Compound Name: | 2-methyl-N-{3-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl}propanamide |
| Molecular Weight: | 396.44 |
| Molecular Formula: | C21 H24 N4 O4 |
| Smiles: | CC(C)C(Nc1cccc(c1)C(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1725 |
| logD: | 3.1725 |
| logSw: | -3.4478 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.891 |
| InChI Key: | CIMFDERWQGYJPD-UHFFFAOYSA-N |