| MolName | (5Z)-5-[(3-bromophenyl)methylidene]-3-(3-chlorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C16H9NOBrClS2 |
| Smiles | O=C(/C(/SC1=S)=C/c2cccc(Br)c2)N1c1cc(Cl)ccc1 |
| InChI | InChI=1S/C16H9BrClNOS2/c17-11-4-1-3-10(7-11)8-14-15(20)19(16(21)22-14)13-6-2-5-12(18)9-13/h1-9H |
| InChIK | NTPVTYNAPQPAJG-UHFFFAOYSA-N |
| TotalMolweight | 410.742 |
| Molweight | 410.742 |
| MonoisotopicMass | 408.899742 |
| CLogP | 4.2235 |
| CLogS | -6.553 |
| H Acceptors | 2 |
| TotalSurfaceArea | 256.53 |
| Relative PSA | 0.242 |
| PolarSurfaceArea | 77.7 |
| Druglikeness | 1.0396 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.54545 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - (5Z)-5-[(3-bromophenyl)methylidene]-3-(3-chlorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-5-[(3-bromophenyl)methylidene]-3-(3-chlorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one