1-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-(2-phenyl-1,3-benzoxazol-5-yl)methanimine
Chemical Structure Depiction of
1-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-(2-phenyl-1,3-benzoxazol-5-yl)methanimine
1-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-(2-phenyl-1,3-benzoxazol-5-yl)methanimine
Compound characteristics
| Compound ID: | 8004-0788 |
| Compound Name: | 1-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-(2-phenyl-1,3-benzoxazol-5-yl)methanimine |
| Molecular Weight: | 387.35 |
| Molecular Formula: | C21 H13 N3 O5 |
| Smiles: | C1Oc2cc(/C=N/c3ccc4c(c3)nc(c3ccccc3)o4)c(cc2O1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5271 |
| logD: | 4.527 |
| logSw: | -4.5694 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.372 |
| InChI Key: | GFTGLXYYEKABOO-UHFFFAOYSA-N |