4-methyl-5-{2-[(2-methylpropyl)sulfamoyl]-4-nitrophenoxy}-1-(propan-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-methyl-5-{2-[(2-methylpropyl)sulfamoyl]-4-nitrophenoxy}-1-(propan-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide
4-methyl-5-{2-[(2-methylpropyl)sulfamoyl]-4-nitrophenoxy}-1-(propan-2-yl)-N-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V027-8863 |
| Compound Name: | 4-methyl-5-{2-[(2-methylpropyl)sulfamoyl]-4-nitrophenoxy}-1-(propan-2-yl)-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: | CC(C)CNS(c1cc(ccc1Oc1c(C)c(C(NCc2cccc(c2)C(F)(F)F)=O)nn1C(C)C)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3587 |
| logD: | 5.3585 |
| logSw: | -5.5662 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 121.629 |
| InChI Key: | UJWIIQVGYMUSMI-UHFFFAOYSA-N |