3-(2,4-dichlorophenoxy)-1-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
3-(2,4-dichlorophenoxy)-1-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
3-(2,4-dichlorophenoxy)-1-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | 8014-1714 |
| Compound Name: | 3-(2,4-dichlorophenoxy)-1-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 417.2 |
| Molecular Formula: | C19 H10 Cl2 N2 O5 |
| Smiles: | c1ccc2c(c1)NC(c1c(cc(cc1O2)Oc1ccc(cc1[Cl])[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4244 |
| logD: | 4.7911 |
| logSw: | -6.2638 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.255 |
| InChI Key: | VWLNBXVRHQVADO-UHFFFAOYSA-N |