5-[(2-chloro-6-fluorophenyl)methylidene]-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
5-[(2-chloro-6-fluorophenyl)methylidene]-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
5-[(2-chloro-6-fluorophenyl)methylidene]-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 1611-4731 |
| Compound Name: | 5-[(2-chloro-6-fluorophenyl)methylidene]-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 459.95 |
| Molecular Formula: | C21 H15 Cl F N3 O2 S2 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)N1C(/C(=C/c2c(cccc2[Cl])F)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5387 |
| logD: | 3.5387 |
| logSw: | -3.8766 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 35.931 |
| InChI Key: | ZUNLWBKKTBRQGO-UHFFFAOYSA-N |