3-butyl-5-{[1-phenyl-3-(2,4,6-trimethylphenyl)-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-butyl-5-{[1-phenyl-3-(2,4,6-trimethylphenyl)-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
3-butyl-5-{[1-phenyl-3-(2,4,6-trimethylphenyl)-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 4476-1449 |
| Compound Name: | 3-butyl-5-{[1-phenyl-3-(2,4,6-trimethylphenyl)-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 461.65 |
| Molecular Formula: | C26 H27 N3 O S2 |
| Smiles: | CCCCN1C(/C(=C/c2cn(c3ccccc3)nc2c2c(C)cc(C)cc2C)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1003 |
| logD: | 7.1003 |
| logSw: | -5.5951 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 31.3249 |
| InChI Key: | LGFAYKQFKPIQLA-UHFFFAOYSA-N |