2-(benzylsulfanyl)-4-nitro-N-octylbenzamide
Chemical Structure Depiction of
2-(benzylsulfanyl)-4-nitro-N-octylbenzamide
2-(benzylsulfanyl)-4-nitro-N-octylbenzamide
Compound characteristics
| Compound ID: | 8012-3466 |
| Compound Name: | 2-(benzylsulfanyl)-4-nitro-N-octylbenzamide |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C22 H28 N2 O3 S |
| Smiles: | CCCCCCCCNC(c1ccc(cc1SCc1ccccc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4107 |
| logD: | 6.4107 |
| logSw: | -5.6298 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.875 |
| InChI Key: | SIBUBLABMJANOI-UHFFFAOYSA-N |