5-{[3-(3-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-{[3-(3-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-{[3-(3-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | Y070-1342 |
| Compound Name: | 5-{[3-(3-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 491.67 |
| Molecular Formula: | C27 H29 N3 O2 S2 |
| Smiles: | CCCOc1ccc(cc1C)c1c(/C=C2/C(N(CC(C)C)C(=S)S2)=O)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.2659 |
| logD: | 7.2659 |
| logSw: | -5.6114 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 38.851 |
| InChI Key: | KZANXRDWEQBFKR-UHFFFAOYSA-N |