(5E)-5-[(4-fluorophenyl)methylidene]-3-(furan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Formula:C15H10NO2FS2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5E)-5-[(4-fluorophenyl)methylidene]-3-(furan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.
| MolName | (5E)-5-[(4-fluorophenyl)methylidene]-3-(furan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C15H10NO2FS2 |
| Smiles | O=C(/C(/S1)=C\c(cc2)ccc2F)N(Cc2ccco2)C1=S |
| InChI | InChI=1S/C15H10FNO2S2/c16-11-5-3-10(4-6-11)8-13-14(18)17(15(20)21-13)9-12-2-1-7-19-12/h1-8H,9H2 |
| InChIK | DPPHFGGCQZJXBI-UHFFFAOYSA-N |
| TotalMolweight | 319.379 |
| Molweight | 319.379 |
| MonoisotopicMass | 319.013697 |
| CLogP | 2.1047 |
| CLogS | -4.457 |
| H Acceptors | 3 |
| TotalSurfaceArea | 232.28 |
| Relative PSA | 0.32801 |
| PolarSurfaceArea | 90.84 |
| Druglikeness | 2.3848 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61905 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - (5E)-5-[(4-fluorophenyl)methylidene]-3-(furan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5E)-5-[(4-fluorophenyl)methylidene]-3-(furan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off