1-(4-chlorophenoxy)-7-methyl-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
1-(4-chlorophenoxy)-7-methyl-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
1-(4-chlorophenoxy)-7-methyl-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | 8012-9721 |
| Compound Name: | 1-(4-chlorophenoxy)-7-methyl-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 396.79 |
| Molecular Formula: | C20 H13 Cl N2 O5 |
| Smiles: | Cc1ccc2c(c1)Oc1cc(cc(c1C(N2)=O)Oc1ccc(cc1)[Cl])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7122 |
| logD: | 5.6778 |
| logSw: | -6.2619 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.556 |
| InChI Key: | ZQOIAUYEJQVMRH-UHFFFAOYSA-N |