2-{[(2-benzyl-1,3-benzoxazol-5-yl)imino]methyl}-4-nitrophenol
Chemical Structure Depiction of
2-{[(2-benzyl-1,3-benzoxazol-5-yl)imino]methyl}-4-nitrophenol
2-{[(2-benzyl-1,3-benzoxazol-5-yl)imino]methyl}-4-nitrophenol
Compound characteristics
| Compound ID: | 8006-2328 |
| Compound Name: | 2-{[(2-benzyl-1,3-benzoxazol-5-yl)imino]methyl}-4-nitrophenol |
| Molecular Weight: | 373.37 |
| Molecular Formula: | C21 H15 N3 O4 |
| Smiles: | C(c1ccccc1)c1nc2cc(ccc2o1)/N=C/c1cc(ccc1O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.916 |
| logD: | 3.0646 |
| logSw: | -4.6172 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.771 |
| InChI Key: | DPDHCMQXDNFQIY-UHFFFAOYSA-N |