4-({[4-(dimethylamino)phenyl]imino}methyl)phenyl 3,5-dinitrobenzoate
Chemical Structure Depiction of
4-({[4-(dimethylamino)phenyl]imino}methyl)phenyl 3,5-dinitrobenzoate
4-({[4-(dimethylamino)phenyl]imino}methyl)phenyl 3,5-dinitrobenzoate
Compound characteristics
| Compound ID: | 8003-1891 |
| Compound Name: | 4-({[4-(dimethylamino)phenyl]imino}methyl)phenyl 3,5-dinitrobenzoate |
| Molecular Weight: | 434.41 |
| Molecular Formula: | C22 H18 N4 O6 |
| Smiles: | CN(C)c1ccc(cc1)/N=C/c1ccc(cc1)OC(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9845 |
| logD: | 3.9062 |
| logSw: | -4.2047 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 98.312 |
| InChI Key: | SNVLAOAKFYWCNH-UHFFFAOYSA-N |