3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | 8014-2098 |
| Compound Name: | 3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 256.21 |
| Molecular Formula: | C13 H8 N2 O4 |
| Smiles: | c1ccc2c(c1)NC(c1ccc(cc1O2)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8429 |
| logD: | 2.828 |
| logSw: | -3.7763 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.722 |
| InChI Key: | ZECJBSVSQDIAAF-UHFFFAOYSA-N |