1-tert-butyl-4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-tert-butyl-4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide
1-tert-butyl-4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V030-8417 |
| Compound Name: | 1-tert-butyl-4-methyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 597.61 |
| Molecular Formula: | C26 H30 F3 N5 O6 S |
| Salt: | not_available |
| Smiles: | CCCNS(c1cc(ccc1Oc1c(C)c(C(NCc2cccc(c2)C(F)(F)F)=O)nn1C(C)(C)C)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3304 |
| logD: | 5.3303 |
| logSw: | -5.4991 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 121.833 |
| InChI Key: | GPOCQIWOIXZDPR-UHFFFAOYSA-N |