N-[(4-chlorophenyl)methyl]-4,5-dimethoxy-2-nitrobenzamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-4,5-dimethoxy-2-nitrobenzamide
N-[(4-chlorophenyl)methyl]-4,5-dimethoxy-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-1997 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-4,5-dimethoxy-2-nitrobenzamide |
| Molecular Weight: | 350.76 |
| Molecular Formula: | C16 H15 Cl N2 O5 |
| Smiles: | COc1cc(C(NCc2ccc(cc2)[Cl])=O)c(cc1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1 |
| logD: | 3.098 |
| logSw: | -3.6294 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.993 |
| InChI Key: | QVRHSZLGGYFPLR-UHFFFAOYSA-N |