3-chloro-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
3-chloro-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]benzene-1-sulfonamide
3-chloro-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G580-0049 |
| Compound Name: | 3-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(c2cccc(c2)[Cl])(=O)=O)c(C)n(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.9794 |
| logD: | 1.9642 |
| logSw: | -2.917 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.836 |
| InChI Key: | JSHDCAANTSGXQD-UHFFFAOYSA-N |