N-(3-chloro-4-fluorophenyl)-4,5-dimethoxy-2-nitrobenzamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-4,5-dimethoxy-2-nitrobenzamide
N-(3-chloro-4-fluorophenyl)-4,5-dimethoxy-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-0237 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-4,5-dimethoxy-2-nitrobenzamide |
| Molecular Weight: | 354.72 |
| Molecular Formula: | C15 H12 Cl F N2 O5 |
| Smiles: | COc1cc(C(Nc2ccc(c(c2)[Cl])F)=O)c(cc1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2717 |
| logD: | 1.8514 |
| logSw: | -3.8558 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.671 |
| InChI Key: | YBZKKTGXKCHHGO-UHFFFAOYSA-N |