| MolName | (5Z)-5-[[3-(2-phenoxyethoxy)phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C18H15NO3S2 |
| Smiles | O=C(/C(/S1)=C/c2cc(OCCOc3ccccc3)ccc2)NC1=S |
| InChI | InChI=1S/C18H15NO3S2/c20-17-16(24-18(23)19-17)12-13-5-4-8-15(11-13)22-10-9-21-14-6-2-1-3-7-14/h1-8,11-12H,9-10H2,(H,19,20,23) |
| InChIK | CZCBVWNKTKAAJH-UHFFFAOYSA-N |
| TotalMolweight | 357.453 |
| Molweight | 357.453 |
| MonoisotopicMass | 357.049334 |
| CLogP | 2.4992 |
| CLogS | -4.768 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 271.16 |
| Relative PSA | 0.33187 |
| PolarSurfaceArea | 104.95 |
| Druglikeness | -4.708 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - (5Z)-5-[[3-(2-phenoxyethoxy)phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-5-[[3-(2-phenoxyethoxy)phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one