5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-4-methyl-N-[(oxolan-2-yl)methyl]-1-(propan-2-yl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-4-methyl-N-[(oxolan-2-yl)methyl]-1-(propan-2-yl)-1H-pyrazole-3-carboxamide
5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-4-methyl-N-[(oxolan-2-yl)methyl]-1-(propan-2-yl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V005-0094 |
| Compound Name: | 5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-4-methyl-N-[(oxolan-2-yl)methyl]-1-(propan-2-yl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 523.61 |
| Molecular Formula: | C23 H33 N5 O7 S |
| Salt: | not_available |
| Smiles: | CC(C)n1c(c(C)c(C(NCC2CCCO2)=O)n1)Oc1ccc(cc1S(NC(C)(C)C)(=O)=O)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.739 |
| logD: | 2.7388 |
| logSw: | -3.4023 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 129.32 |
| InChI Key: | QMAVAYVZKYXUJZ-QGZVFWFLSA-N |