N-(butan-2-yl)-5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(2,3-dimethylphenyl)-4-methyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(butan-2-yl)-5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(2,3-dimethylphenyl)-4-methyl-1H-pyrazole-3-carboxamide
N-(butan-2-yl)-5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(2,3-dimethylphenyl)-4-methyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V008-4583 |
| Compound Name: | N-(butan-2-yl)-5-{2-[(butan-2-yl)sulfamoyl]-4-nitrophenoxy}-1-(2,3-dimethylphenyl)-4-methyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 557.67 |
| Molecular Formula: | C27 H35 N5 O6 S |
| Smiles: | CCC(C)NC(c1c(C)c(n(c2cccc(C)c2C)n1)Oc1ccc(cc1S(NC(C)CC)(=O)=O)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2804 |
| logD: | 5.2802 |
| logSw: | -5.2516 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 120.092 |
| InChI Key: | GTTDTNHVLFDKDE-UHFFFAOYSA-N |