N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N-methyl-4-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N-methyl-4-nitrobenzene-1-sulfonamide
N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N-methyl-4-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y501-5099 |
| Compound Name: | N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N-methyl-4-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 324.36 |
| Molecular Formula: | C13 H16 N4 O4 S |
| Smiles: | Cc1c(CN(C)S(c2ccc(cc2)[N+]([O-])=O)(=O)=O)cn(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.3677 |
| logD: | 1.3677 |
| logSw: | -2.3715 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.346 |
| InChI Key: | KRAXYOLTZKIRHC-UHFFFAOYSA-N |