1-tert-butyl-5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-N-[(furan-2-yl)methyl]-4-methyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-tert-butyl-5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-N-[(furan-2-yl)methyl]-4-methyl-1H-pyrazole-3-carboxamide
1-tert-butyl-5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-N-[(furan-2-yl)methyl]-4-methyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V008-3310 |
| Compound Name: | 1-tert-butyl-5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-N-[(furan-2-yl)methyl]-4-methyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 533.6 |
| Molecular Formula: | C24 H31 N5 O7 S |
| Smiles: | Cc1c(C(NCc2ccco2)=O)nn(c1Oc1ccc(cc1S(NC(C)(C)C)(=O)=O)[N+]([O-])=O)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.1444 |
| logD: | 4.1441 |
| logSw: | -4.3904 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 128.778 |
| InChI Key: | KKGICPOYSRKGKR-UHFFFAOYSA-N |