4-({[3-(2,4-dinitrophenoxy)phenyl]methylidene}amino)-2-(4-methyl-1,3-benzoxazol-2-yl)phenol
Chemical Structure Depiction of
4-({[3-(2,4-dinitrophenoxy)phenyl]methylidene}amino)-2-(4-methyl-1,3-benzoxazol-2-yl)phenol
4-({[3-(2,4-dinitrophenoxy)phenyl]methylidene}amino)-2-(4-methyl-1,3-benzoxazol-2-yl)phenol
Compound characteristics
| Compound ID: | 8005-7337 |
| Compound Name: | 4-({[3-(2,4-dinitrophenoxy)phenyl]methylidene}amino)-2-(4-methyl-1,3-benzoxazol-2-yl)phenol |
| Molecular Weight: | 510.46 |
| Molecular Formula: | C27 H18 N4 O7 |
| Smiles: | Cc1cccc2c1nc(c1cc(ccc1O)/N=C/c1cccc(c1)Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 6.4876 |
| logD: | 6.4861 |
| logSw: | -5.8168 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 115.791 |
| InChI Key: | QIXPDMCFIKHHLX-UHFFFAOYSA-N |