5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-pentyl-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-pentyl-2-sulfanylidene-1,3-thiazolidin-4-one
5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-pentyl-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | Y070-1079 |
| Compound Name: | 5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-pentyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 477.65 |
| Molecular Formula: | C26 H27 N3 O2 S2 |
| Smiles: | CCCCCN1C(/C(=C/c2cn(c3ccccc3)nc2c2ccc(cc2)OCC)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6831 |
| logD: | 6.6831 |
| logSw: | -5.6395 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 38.449 |
| InChI Key: | RLNXWRMXABMNNR-UHFFFAOYSA-N |