4-[(2-chloro-4-nitrophenoxy)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]benzamide
Chemical Structure Depiction of
4-[(2-chloro-4-nitrophenoxy)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]benzamide
4-[(2-chloro-4-nitrophenoxy)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]benzamide
Compound characteristics
| Compound ID: | Y500-6855 |
| Compound Name: | 4-[(2-chloro-4-nitrophenoxy)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]benzamide |
| Molecular Weight: | 442.9 |
| Molecular Formula: | C22 H23 Cl N4 O4 |
| Smiles: | Cc1cc(C)n(CCCNC(c2ccc(COc3ccc(cc3[Cl])[N+]([O-])=O)cc2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.0449 |
| logD: | 3.0448 |
| logSw: | -3.5601 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.174 |
| InChI Key: | GWJGANXPLWLHAM-UHFFFAOYSA-N |