N-{1-[(2-chloro-6-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-2-(4-nitrophenyl)acetamide
Chemical Structure Depiction of
N-{1-[(2-chloro-6-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-2-(4-nitrophenyl)acetamide
N-{1-[(2-chloro-6-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-2-(4-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | Y205-0388 |
| Compound Name: | N-{1-[(2-chloro-6-fluorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-2-(4-nitrophenyl)acetamide |
| Molecular Weight: | 416.84 |
| Molecular Formula: | C20 H18 Cl F N4 O3 |
| Smiles: | Cc1c(c(C)n(Cc2c(cccc2[Cl])F)n1)NC(Cc1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1102 |
| logD: | 3.1099 |
| logSw: | -3.4488 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.384 |
| InChI Key: | SHOZSHKJALRECR-UHFFFAOYSA-N |