3-hexyl-5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-hexyl-5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
3-hexyl-5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | Y070-1083 |
| Compound Name: | 3-hexyl-5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 461.65 |
| Molecular Formula: | C26 H27 N3 O S2 |
| Smiles: | CCCCCCN1C(/C(=C/c2cn(c3ccccc3)nc2c2ccc(C)cc2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 7.2334 |
| logD: | 7.2334 |
| logSw: | -5.6249 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 31.3249 |
| InChI Key: | JJCJKSUPCACYLS-UHFFFAOYSA-N |