N~1~-{2-[4-(3-nitrobenzoyl)piperazin-1-yl]ethyl}-N~2~-phenylethanediamide
Chemical Structure Depiction of
N~1~-{2-[4-(3-nitrobenzoyl)piperazin-1-yl]ethyl}-N~2~-phenylethanediamide
N~1~-{2-[4-(3-nitrobenzoyl)piperazin-1-yl]ethyl}-N~2~-phenylethanediamide
Compound characteristics
| Compound ID: | 8002-0605 |
| Compound Name: | N~1~-{2-[4-(3-nitrobenzoyl)piperazin-1-yl]ethyl}-N~2~-phenylethanediamide |
| Molecular Weight: | 425.44 |
| Molecular Formula: | C21 H23 N5 O5 |
| Smiles: | C(CN1CCN(CC1)C(c1cccc(c1)[N+]([O-])=O)=O)NC(C(Nc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8136 |
| logD: | 0.7147 |
| logSw: | -2.3106 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.676 |
| InChI Key: | OPIQKPKRADRYEH-UHFFFAOYSA-N |