1-(2,4-dibromophenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
1-(2,4-dibromophenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
1-(2,4-dibromophenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | 8012-5237 |
| Compound Name: | 1-(2,4-dibromophenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 506.1 |
| Molecular Formula: | C19 H10 Br2 N2 O5 |
| Smiles: | c1ccc2c(c1)NC(c1c(cc(cc1Oc1ccc(cc1[Br])[Br])[N+]([O-])=O)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9662 |
| logD: | 5.9399 |
| logSw: | -5.9474 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.643 |
| InChI Key: | BYSPHKNFXWBMQH-UHFFFAOYSA-N |