5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | Y070-1088 |
| Compound Name: | 5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 463.62 |
| Molecular Formula: | C25 H25 N3 O2 S2 |
| Smiles: | CCOc1ccc(cc1)c1c(/C=C2/C(N(CC(C)C)C(=S)S2)=O)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.0134 |
| logD: | 6.0134 |
| logSw: | -5.4514 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 38.47 |
| InChI Key: | IYJCULGDIRCFDB-UHFFFAOYSA-N |