1-nitro-3-(phenylsulfanyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
1-nitro-3-(phenylsulfanyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
1-nitro-3-(phenylsulfanyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | 8013-2550 |
| Compound Name: | 1-nitro-3-(phenylsulfanyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 364.38 |
| Molecular Formula: | C19 H12 N2 O4 S |
| Smiles: | c1ccc(cc1)Sc1cc(c2C(Nc3ccccc3Oc2c1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0044 |
| logD: | 4.2211 |
| logSw: | -5.0023 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.149 |
| InChI Key: | GWICKSQYLPEDRR-UHFFFAOYSA-N |