5-{[3-(4-nitrophenyl)-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-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-{[3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 4476-2311 |
| Compound Name: | 5-{[3-(4-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 448.52 |
| Molecular Formula: | C22 H16 N4 O3 S2 |
| Smiles: | C=CCN1C(/C(=C/c2cn(c3ccccc3)nc2c2ccc(cc2)[N+]([O-])=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8147 |
| logD: | 4.8147 |
| logSw: | -4.8211 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 64.706 |
| InChI Key: | AIGBOKDFGIBLQA-UHFFFAOYSA-N |