5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-1-ethyl-4-methyl-N-propyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-1-ethyl-4-methyl-N-propyl-1H-pyrazole-3-carboxamide
5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-1-ethyl-4-methyl-N-propyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V005-0116 |
| Compound Name: | 5-[2-(tert-butylsulfamoyl)-4-nitrophenoxy]-1-ethyl-4-methyl-N-propyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 467.54 |
| Molecular Formula: | C20 H29 N5 O6 S |
| Salt: | not_available |
| Smiles: | CCCNC(c1c(C)c(n(CC)n1)Oc1ccc(cc1S(NC(C)(C)C)(=O)=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8207 |
| logD: | 2.8204 |
| logSw: | -3.5621 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 120.035 |
| InChI Key: | NDTIIAJBSJUDDP-UHFFFAOYSA-N |