N-benzyl-3-nitro-4-[4-(pyridin-2-yl)piperazin-1-yl]benzamide
Chemical Structure Depiction of
N-benzyl-3-nitro-4-[4-(pyridin-2-yl)piperazin-1-yl]benzamide
N-benzyl-3-nitro-4-[4-(pyridin-2-yl)piperazin-1-yl]benzamide
Compound characteristics
| Compound ID: | K781-3650 |
| Compound Name: | N-benzyl-3-nitro-4-[4-(pyridin-2-yl)piperazin-1-yl]benzamide |
| Molecular Weight: | 417.47 |
| Molecular Formula: | C23 H23 N5 O3 |
| Smiles: | C(c1ccccc1)NC(c1ccc(c(c1)[N+]([O-])=O)N1CCN(CC1)c1ccccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7711 |
| logD: | 3.765 |
| logSw: | -4.1927 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.656 |
| InChI Key: | BWWAFWGMVXEQHX-UHFFFAOYSA-N |