| MolName | (5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C18H15NO2S2 |
| Smiles | Oc1ccc(/C=C(/C(N2CCc3ccccc3)=O)\SC2=S)cc1 |
| InChI | InChI=1S/C18H15NO2S2/c20-15-8-6-14(7-9-15)12-16-17(21)19(18(22)23-16)11-10-13-4-2-1-3-5-13/h1-9,12,20H,10-11H2 |
| InChIK | YHXJSLLNANMGLB-UHFFFAOYSA-N |
| TotalMolweight | 341.454 |
| Molweight | 341.454 |
| MonoisotopicMass | 341.054419 |
| CLogP | 2.8996 |
| CLogS | -4.277 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 256.35 |
| Relative PSA | 0.29327 |
| PolarSurfaceArea | 97.93 |
| Druglikeness | 4.1634 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65217 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 5 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - (5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one