1-[4-(2,4-dinitrophenoxy)-3-ethoxyphenyl]-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]methanimine
Chemical Structure Depiction of
1-[4-(2,4-dinitrophenoxy)-3-ethoxyphenyl]-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]methanimine
1-[4-(2,4-dinitrophenoxy)-3-ethoxyphenyl]-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]methanimine
Compound characteristics
| Compound ID: | 8001-6394 |
| Compound Name: | 1-[4-(2,4-dinitrophenoxy)-3-ethoxyphenyl]-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]methanimine |
| Molecular Weight: | 538.52 |
| Molecular Formula: | C29 H22 N4 O7 |
| Smiles: | CCOc1cc(\C=N/c2cccc(c2)c2nc3cc(C)ccc3o2)ccc1Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.3781 |
| logD: | 6.3761 |
| logSw: | -5.7499 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 105.77 |
| InChI Key: | SHLCDJBGHGMQPR-UHFFFAOYSA-N |