N-ethyl-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-ethyl-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-nitrobenzene-1-sulfonamide
N-ethyl-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y501-5090 |
| Compound Name: | N-ethyl-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 366.44 |
| Molecular Formula: | C16 H22 N4 O4 S |
| Smiles: | CCN(Cc1c(C)nn(CC)c1C)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3221 |
| logD: | 2.3221 |
| logSw: | -2.6478 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.998 |
| InChI Key: | CPQRHFOKUKFTDA-UHFFFAOYSA-N |