| MolName | (5E)-5-(1,2-oxazol-3-ylmethylidene)-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C13H8N2O2S2 |
| Smiles | O=C(/C(/SC1=S)=C\c2nocc2)N1c1ccccc1 |
| InChI | InChI=1S/C13H8N2O2S2/c16-12-11(8-9-6-7-17-14-9)19-13(18)15(12)10-4-2-1-3-5-10/h1-8H |
| InChIK | JBSVUTVLRODGTK-UHFFFAOYSA-N |
| TotalMolweight | 288.351 |
| Molweight | 288.351 |
| MonoisotopicMass | 288.002718 |
| CLogP | 1.3566 |
| CLogS | -4.104 |
| H Acceptors | 4 |
| TotalSurfaceArea | 210.93 |
| Relative PSA | 0.41322 |
| PolarSurfaceArea | 103.73 |
| Druglikeness | 3.9327 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57895 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
Click to Load Molecule:
1 - (5E)-5-(1,2-oxazol-3-ylmethylidene)-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5E)-5-(1,2-oxazol-3-ylmethylidene)-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one