N-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-1-(6-nitro-2H-1,3-benzodioxol-5-yl)methanimine
Chemical Structure Depiction of
N-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-1-(6-nitro-2H-1,3-benzodioxol-5-yl)methanimine
N-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-1-(6-nitro-2H-1,3-benzodioxol-5-yl)methanimine
Compound characteristics
| Compound ID: | 8005-6893 |
| Compound Name: | N-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-1-(6-nitro-2H-1,3-benzodioxol-5-yl)methanimine |
| Molecular Weight: | 456.24 |
| Molecular Formula: | C21 H11 Cl2 N3 O5 |
| Smiles: | C1Oc2cc(/C=N/c3ccc4c(c3)nc(c3ccc(cc3[Cl])[Cl])o4)c(cc2O1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7589 |
| logD: | 5.7588 |
| logSw: | -6.1986 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.372 |
| InChI Key: | FHRLQEQYZKBHPG-UHFFFAOYSA-N |