2-{[N-(1-benzylpiperidin-4-yl)glycyl]amino}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitrobenzamide
Chemical Structure Depiction of
2-{[N-(1-benzylpiperidin-4-yl)glycyl]amino}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitrobenzamide
2-{[N-(1-benzylpiperidin-4-yl)glycyl]amino}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitrobenzamide
Compound characteristics
| Compound ID: | C284-0354 |
| Compound Name: | 2-{[N-(1-benzylpiperidin-4-yl)glycyl]amino}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitrobenzamide |
| Molecular Weight: | 545.6 |
| Molecular Formula: | C29 H31 N5 O6 |
| Smiles: | C1CN(CCC1NCC(Nc1ccc(cc1C(Nc1ccc2c(c1)OCCO2)=O)[N+]([O-])=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.0683 |
| logD: | 1.188 |
| logSw: | -3.3164 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 109.808 |
| InChI Key: | ZNNNYDRATLZKGW-UHFFFAOYSA-N |