(2E,4E)-8-methyl-2,4-bis[(3-nitrophenyl)methylidene]-8-azabicyclo[3.2.1]octan-3-one
Chemical Structure Depiction of
(2E,4E)-8-methyl-2,4-bis[(3-nitrophenyl)methylidene]-8-azabicyclo[3.2.1]octan-3-one
(2E,4E)-8-methyl-2,4-bis[(3-nitrophenyl)methylidene]-8-azabicyclo[3.2.1]octan-3-one
Compound characteristics
| Compound ID: | C151-0841 |
| Compound Name: | (2E,4E)-8-methyl-2,4-bis[(3-nitrophenyl)methylidene]-8-azabicyclo[3.2.1]octan-3-one |
| Molecular Weight: | 405.41 |
| Molecular Formula: | C22 H19 N3 O5 |
| Smiles: | CN1C2CCC1/C(=C\c1cccc(c1)[N+]([O-])=O)C(C/2=C\c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5625 |
| logD: | 4.5587 |
| logSw: | -4.4609 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.225 |
| InChI Key: | PZBPESWOCUIYGF-UHFFFAOYSA-N |