3-butyl-5-({1-phenyl-3-[4-(piperidine-1-sulfonyl)phenyl]-1H-pyrazol-4-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-butyl-5-({1-phenyl-3-[4-(piperidine-1-sulfonyl)phenyl]-1H-pyrazol-4-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
3-butyl-5-({1-phenyl-3-[4-(piperidine-1-sulfonyl)phenyl]-1H-pyrazol-4-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 4476-1453 |
| Compound Name: | 3-butyl-5-({1-phenyl-3-[4-(piperidine-1-sulfonyl)phenyl]-1H-pyrazol-4-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 566.76 |
| Molecular Formula: | C28 H30 N4 O3 S3 |
| Smiles: | CCCCN1C(/C(=C/c2cn(c3ccccc3)nc2c2ccc(cc2)S(N2CCCCC2)(=O)=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.764 |
| logD: | 5.764 |
| logSw: | -5.37 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 63.036 |
| InChI Key: | IUESDLOAXIUEJW-UHFFFAOYSA-N |