N-[4-(butan-2-yl)phenyl]-4-methoxy-3-nitrobenzamide
Chemical Structure Depiction of
N-[4-(butan-2-yl)phenyl]-4-methoxy-3-nitrobenzamide
N-[4-(butan-2-yl)phenyl]-4-methoxy-3-nitrobenzamide
Compound characteristics
| Compound ID: | Y031-9695 |
| Compound Name: | N-[4-(butan-2-yl)phenyl]-4-methoxy-3-nitrobenzamide |
| Molecular Weight: | 328.37 |
| Molecular Formula: | C18 H20 N2 O4 |
| Smiles: | CCC(C)c1ccc(cc1)NC(c1ccc(c(c1)[N+]([O-])=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4476 |
| logD: | 4.447 |
| logSw: | -4.3519 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.041 |
| InChI Key: | IKIRIAOFYUXTEB-LBPRGKRZSA-N |