| MolName | (5Z)-5-[[2-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C14H9N2O2ClS3 |
| Smiles | O=C(/C(/S1)=C/c(cccc2)c2OCc(s2)cnc2Cl)NC1=S |
| InChI | InChI=1S/C14H9ClN2O2S3/c15-13-16-6-9(21-13)7-19-10-4-2-1-3-8(10)5-11-12(18)17-14(20)22-11/h1-6H,7H2,(H,17,18,20) |
| InChIK | HWDOAWGTMMXWPW-UHFFFAOYSA-N |
| TotalMolweight | 368.888 |
| Molweight | 368.888 |
| MonoisotopicMass | 367.951465 |
| CLogP | 2.5053 |
| CLogS | -5.289 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 257.52 |
| Relative PSA | 0.43228 |
| PolarSurfaceArea | 136.85 |
| Druglikeness | 2.339 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.59091 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 4 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (5Z)-5-[[2-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-5-[[2-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one