N-[4-(butan-2-yl)phenyl]-4,5-dimethoxy-2-nitrobenzamide
Chemical Structure Depiction of
N-[4-(butan-2-yl)phenyl]-4,5-dimethoxy-2-nitrobenzamide
N-[4-(butan-2-yl)phenyl]-4,5-dimethoxy-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-0192 |
| Compound Name: | N-[4-(butan-2-yl)phenyl]-4,5-dimethoxy-2-nitrobenzamide |
| Molecular Weight: | 358.39 |
| Molecular Formula: | C19 H22 N2 O5 |
| Smiles: | CCC(C)c1ccc(cc1)NC(c1cc(c(cc1[N+]([O-])=O)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4696 |
| logD: | 4.4666 |
| logSw: | -4.3858 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.671 |
| InChI Key: | PSHCGBYLEJCZPP-LBPRGKRZSA-N |