N-(3-methoxypropyl)-3-methyl-2-nitrobenzamide
Chemical Structure Depiction of
N-(3-methoxypropyl)-3-methyl-2-nitrobenzamide
N-(3-methoxypropyl)-3-methyl-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-3227 |
| Compound Name: | N-(3-methoxypropyl)-3-methyl-2-nitrobenzamide |
| Molecular Weight: | 252.27 |
| Molecular Formula: | C12 H16 N2 O4 |
| Smiles: | Cc1cccc(C(NCCCOC)=O)c1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.0127 |
| logD: | 2.0126 |
| logSw: | -2.6236 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.887 |
| InChI Key: | LOOOOSCCVWADHK-UHFFFAOYSA-N |