N-(4-fluorophenyl)-4-methyl-5-(2-nitrophenoxy)-1-(propan-2-yl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-4-methyl-5-(2-nitrophenoxy)-1-(propan-2-yl)-1H-pyrazole-3-carboxamide
N-(4-fluorophenyl)-4-methyl-5-(2-nitrophenoxy)-1-(propan-2-yl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V030-2942 |
| Compound Name: | N-(4-fluorophenyl)-4-methyl-5-(2-nitrophenoxy)-1-(propan-2-yl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 398.39 |
| Molecular Formula: | C20 H19 F N4 O4 |
| Smiles: | CC(C)n1c(c(C)c(C(Nc2ccc(cc2)F)=O)n1)Oc1ccccc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2631 |
| logD: | 4.2619 |
| logSw: | -4.4549 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.976 |
| InChI Key: | PXNCUPNXUNPFID-UHFFFAOYSA-N |