3-methyl-5-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-methyl-5-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
3-methyl-5-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | Y070-0489 |
| Compound Name: | 3-methyl-5-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 422.48 |
| Molecular Formula: | C20 H14 N4 O3 S2 |
| Smiles: | CN1C(/C(=C/c2cn(c3ccccc3)nc2c2cccc(c2)[N+]([O-])=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1019 |
| logD: | 4.1019 |
| logSw: | -4.3389 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 64.494 |
| InChI Key: | YDEPQHQTZXHIOY-UHFFFAOYSA-N |