1-(2,3-dimethylphenyl)-N,4-dimethyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-propyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-(2,3-dimethylphenyl)-N,4-dimethyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-propyl-1H-pyrazole-3-carboxamide
1-(2,3-dimethylphenyl)-N,4-dimethyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-propyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V027-4475 |
| Compound Name: | 1-(2,3-dimethylphenyl)-N,4-dimethyl-5-[4-nitro-2-(propylsulfamoyl)phenoxy]-N-propyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 543.64 |
| Molecular Formula: | C26 H33 N5 O6 S |
| Salt: | not_available |
| Smiles: | CCCNS(c1cc(ccc1Oc1c(C)c(C(N(C)CCC)=O)nn1c1cccc(C)c1C)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2854 |
| logD: | 5.2852 |
| logSw: | -5.3358 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.553 |
| InChI Key: | PNIBSQIMMCMCTA-UHFFFAOYSA-N |