N'-[(2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecin-12-yl)methylidene]-4-nitrobenzohydrazide
Chemical Structure Depiction of
N'-[(2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecin-12-yl)methylidene]-4-nitrobenzohydrazide
N'-[(2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecin-12-yl)methylidene]-4-nitrobenzohydrazide
Compound characteristics
| Compound ID: | 8004-3195 |
| Compound Name: | N'-[(2,3,5,6,8,9-hexahydro-1,4,7,10-benzotetraoxacyclododecin-12-yl)methylidene]-4-nitrobenzohydrazide |
| Molecular Weight: | 415.4 |
| Molecular Formula: | C20 H21 N3 O7 |
| Smiles: | C1COCCOc2cc(/C=N/NC(c3ccc(cc3)[N+]([O-])=O)=O)ccc2OCCO1 |
| Stereo: | ACHIRAL |
| logP: | 1.7433 |
| logD: | 1.7371 |
| logSw: | -2.4173 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.907 |
| InChI Key: | DIUYKZFOOWEHDW-UHFFFAOYSA-N |