5-{[3-(1,3-benzothiazol-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-{[3-(1,3-benzothiazol-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-{[3-(1,3-benzothiazol-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | Y070-1571 |
| Compound Name: | 5-{[3-(1,3-benzothiazol-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 460.6 |
| Molecular Formula: | C23 H16 N4 O S3 |
| Smiles: | C=CCN1C(/C(=C/c2cn(c3ccccc3)nc2c2nc3ccccc3s2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.496 |
| logD: | 5.496 |
| logSw: | -5.6577 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 41.045 |
| InChI Key: | YHQHRACCWXSTJL-UHFFFAOYSA-N |