2-chloro-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
2-chloro-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]benzene-1-sulfonamide
2-chloro-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G580-0050 |
| Compound Name: | 2-chloro-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 313.8 |
| Molecular Formula: | C13 H16 Cl N3 O2 S |
| Smiles: | Cc1c(CNS(c2ccccc2[Cl])(=O)=O)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.5959 |
| logD: | 1.5808 |
| logSw: | -2.648 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.836 |
| InChI Key: | QQBRLWLKROTQQB-UHFFFAOYSA-N |