2-(benzenesulfonyl)-3-[3-(3-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enenitrile
Chemical Structure Depiction of
2-(benzenesulfonyl)-3-[3-(3-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enenitrile
2-(benzenesulfonyl)-3-[3-(3-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 4341-1681 |
| Compound Name: | 2-(benzenesulfonyl)-3-[3-(3-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enenitrile |
| Molecular Weight: | 483.59 |
| Molecular Formula: | C28 H25 N3 O3 S |
| Smiles: | CCCOc1ccc(cc1C)c1c(\C=C(/C#N)S(c2ccccc2)(=O)=O)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.1967 |
| logD: | 6.1967 |
| logSw: | -5.6841 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.932 |
| InChI Key: | AFZXSLDFEZPUFE-UHFFFAOYSA-N |