1-tert-butyl-5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-N-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-tert-butyl-5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-N-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxamide
1-tert-butyl-5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-N-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V029-9748 |
| Compound Name: | 1-tert-butyl-5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-N-(4-fluorophenyl)-4-methyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 547.61 |
| Molecular Formula: | C25 H30 F N5 O6 S |
| Salt: | not_available |
| Smiles: | Cc1c(C(Nc2ccc(cc2)F)=O)nn(c1Oc1ccc(cc1S(NC(C)(C)C)(=O)=O)[N+]([O-])=O)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.8316 |
| logD: | 4.8304 |
| logSw: | -4.8066 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 119.707 |
| InChI Key: | IJLVDPMMPXPMNE-UHFFFAOYSA-N |