1-(2-bromophenoxy)-8-chloro-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
1-(2-bromophenoxy)-8-chloro-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
1-(2-bromophenoxy)-8-chloro-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | 8012-9852 |
| Compound Name: | 1-(2-bromophenoxy)-8-chloro-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 461.65 |
| Molecular Formula: | C19 H10 Br Cl N2 O5 |
| Smiles: | c1ccc(c(c1)Oc1cc(cc2c1C(Nc1cc(ccc1O2)[Cl])=O)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.7257 |
| logD: | 4.9683 |
| logSw: | -6.2722 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.643 |
| InChI Key: | KJNAMQLOPMEZMN-UHFFFAOYSA-N |