4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-1-(propan-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-1-(propan-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide
4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-1-(propan-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V030-8416 |
| Compound Name: | 4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-1-(propan-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 583.59 |
| Molecular Formula: | C25 H28 F3 N5 O6 S |
| Salt: | not_available |
| Smiles: | CCCNS(c1cc(ccc1Oc1c(C)c(C(NCc2cccc(c2)C(F)(F)F)=O)nn1C(C)C)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1251 |
| logD: | 5.1249 |
| logSw: | -5.1597 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 121.47 |
| InChI Key: | UBBVGYUPVFQXRL-UHFFFAOYSA-N |