1-(3-methylphenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
1-(3-methylphenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
1-(3-methylphenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | 8011-6631 |
| Compound Name: | 1-(3-methylphenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 362.34 |
| Molecular Formula: | C20 H14 N2 O5 |
| Smiles: | Cc1cccc(c1)Oc1cc(cc2c1C(Nc1ccccc1O2)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.017 |
| logD: | 4.9907 |
| logSw: | -4.884 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.556 |
| InChI Key: | ADNJZULYIZTTIO-UHFFFAOYSA-N |