3-nitro-1-(phenylsulfanyl)dibenzo[b,f]oxepine
Chemical Structure Depiction of
3-nitro-1-(phenylsulfanyl)dibenzo[b,f]oxepine
3-nitro-1-(phenylsulfanyl)dibenzo[b,f]oxepine
Compound characteristics
| Compound ID: | 8013-2002 |
| Compound Name: | 3-nitro-1-(phenylsulfanyl)dibenzo[b,f]oxepine |
| Molecular Weight: | 347.39 |
| Molecular Formula: | C20 H13 N O3 S |
| Smiles: | C1=Cc2c(cc(cc2Sc2ccccc2)[N+]([O-])=O)Oc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 5.8726 |
| logD: | 5.8726 |
| logSw: | -6.035 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.493 |
| InChI Key: | LZKVZCSMIAEIAC-UHFFFAOYSA-N |