3-butyl-5-({1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-butyl-5-({1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
3-butyl-5-({1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | Y070-1763 |
| Compound Name: | 3-butyl-5-({1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 493.71 |
| Molecular Formula: | C26 H27 N3 O S3 |
| Smiles: | CCCCN1C(/C(=C/c2cn(c3ccccc3)nc2c2ccc(cc2)SCCC)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9912 |
| logD: | 6.9912 |
| logSw: | -5.7245 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 31.3249 |
| InChI Key: | QVKOANROJNECMI-UHFFFAOYSA-N |