1-(2-bromophenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
1-(2-bromophenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
1-(2-bromophenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | 8012-4573 |
| Compound Name: | 1-(2-bromophenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 427.21 |
| Molecular Formula: | C19 H11 Br N2 O5 |
| Smiles: | c1ccc2c(c1)NC(c1c(cc(cc1Oc1ccccc1[Br])[N+]([O-])=O)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2259 |
| logD: | 5.1996 |
| logSw: | -5.4096 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.643 |
| InChI Key: | MLKPLRSMARRAMV-UHFFFAOYSA-N |