(azepan-1-yl)(4,5-dimethoxy-2-nitrophenyl)methanone
Chemical Structure Depiction of
(azepan-1-yl)(4,5-dimethoxy-2-nitrophenyl)methanone
(azepan-1-yl)(4,5-dimethoxy-2-nitrophenyl)methanone
Compound characteristics
| Compound ID: | Y032-0206 |
| Compound Name: | (azepan-1-yl)(4,5-dimethoxy-2-nitrophenyl)methanone |
| Molecular Weight: | 308.33 |
| Molecular Formula: | C15 H20 N2 O5 |
| Smiles: | COc1cc(C(N2CCCCCC2)=O)c(cc1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3216 |
| logD: | 2.3216 |
| logSw: | -2.5796 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.559 |
| InChI Key: | LTCCUULQQPGRNC-UHFFFAOYSA-N |