4-chloro-1-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)-1H-pyrazole
Chemical Structure Depiction of
4-chloro-1-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)-1H-pyrazole
4-chloro-1-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)-1H-pyrazole
Compound characteristics
| Compound ID: | Y205-7104 |
| Compound Name: | 4-chloro-1-(2,3,4,5,6-pentamethylbenzene-1-sulfonyl)-1H-pyrazole |
| Molecular Weight: | 312.82 |
| Molecular Formula: | C14 H17 Cl N2 O2 S |
| Smiles: | Cc1c(C)c(C)c(c(C)c1C)S(n1cc(cn1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0401 |
| logD: | 4.0401 |
| logSw: | -4.2726 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.957 |
| InChI Key: | XKLCDMITUDMSSX-UHFFFAOYSA-N |