N~1~-(4-methylphenyl)-N~2~-{2-[4-(4-nitrobenzoyl)piperazin-1-yl]ethyl}ethanediamide
Chemical Structure Depiction of
N~1~-(4-methylphenyl)-N~2~-{2-[4-(4-nitrobenzoyl)piperazin-1-yl]ethyl}ethanediamide
N~1~-(4-methylphenyl)-N~2~-{2-[4-(4-nitrobenzoyl)piperazin-1-yl]ethyl}ethanediamide
Compound characteristics
| Compound ID: | 8004-5648 |
| Compound Name: | N~1~-(4-methylphenyl)-N~2~-{2-[4-(4-nitrobenzoyl)piperazin-1-yl]ethyl}ethanediamide |
| Molecular Weight: | 439.47 |
| Molecular Formula: | C22 H25 N5 O5 |
| Smiles: | Cc1ccc(cc1)NC(C(NCCN1CCN(CC1)C(c1ccc(cc1)[N+]([O-])=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4926 |
| logD: | 1.3674 |
| logSw: | -2.3543 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.676 |
| InChI Key: | UQXGYXARQFBBGA-UHFFFAOYSA-N |