N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl]-N-methyl-4-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl]-N-methyl-4-nitrobenzene-1-sulfonamide
N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl]-N-methyl-4-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y501-6854 |
| Compound Name: | N-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl]-N-methyl-4-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 352.37 |
| Molecular Formula: | C14 H16 N4 O5 S |
| Smiles: | Cc1cc(C)n(C(CN(C)S(c2ccc(cc2)[N+]([O-])=O)(=O)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.8256 |
| logD: | 0.8256 |
| logSw: | -2.3382 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 92.996 |
| InChI Key: | VONUUWXNRJTCNU-UHFFFAOYSA-N |