3-butyl-5-({3-[4-(ethylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-butyl-5-({3-[4-(ethylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
3-butyl-5-({3-[4-(ethylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | Y070-1834 |
| Compound Name: | 3-butyl-5-({3-[4-(ethylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 479.68 |
| Molecular Formula: | C25 H25 N3 O S3 |
| Smiles: | CCCCN1C(/C(=C/c2cn(c3ccccc3)nc2c2ccc(cc2)SCC)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 6.68 |
| logD: | 6.68 |
| logSw: | -5.6987 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 31.3249 |
| InChI Key: | HXBYSRZZTNYNEH-UHFFFAOYSA-N |