5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-1-(4-methoxyphenyl)-4-methyl-N-[(oxolan-2-yl)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-1-(4-methoxyphenyl)-4-methyl-N-[(oxolan-2-yl)methyl]-1H-pyrazole-3-carboxamide
5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-1-(4-methoxyphenyl)-4-methyl-N-[(oxolan-2-yl)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V030-7470 |
| Compound Name: | 5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-1-(4-methoxyphenyl)-4-methyl-N-[(oxolan-2-yl)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 587.65 |
| Molecular Formula: | C27 H33 N5 O8 S |
| Salt: | not_available |
| Smiles: | Cc1c(C(NCC2CCCO2)=O)nn(c2ccc(cc2)OC)c1Oc1ccc(cc1S(NC(C)(C)C)(=O)=O)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4793 |
| logD: | 3.479 |
| logSw: | -3.9615 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 136.26 |
| InChI Key: | XPWPQGJLRGJGJA-OAQYLSRUSA-N |