(5Z)-5-[[5-chloro-2-[(2-fluorophenyl)methoxy]phenyl]methylidene]-3-(3-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Formula:C23H14NO2ClF2S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5Z)-5-[[5-chloro-2-[(2-fluorophenyl)methoxy]phenyl]methylidene]-3-(3-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one is not a drug-like molecule.
| MolName | (5Z)-5-[[5-chloro-2-[(2-fluorophenyl)methoxy]phenyl]methylidene]-3-(3-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C23H14NO2ClF2S2 |
| Smiles | O=C(/C(/SC1=S)=C/c(cc(cc2)Cl)c2OCc(cccc2)c2F)N1c1cc(F)ccc1 |
| InChI | InChI=1S/C23H14ClF2NO2S2/c24-16-8-9-20(29-13-14-4-1-2-7-19(14)26)15(10-16)11-21-22(28)27(23(30)31-21)18-6-3-5-17(25)12-18/h1-12H,13H2 |
| InChIK | BLCXNPOWEUCUPP-UHFFFAOYSA-N |
| TotalMolweight | 473.95 |
| Molweight | 473.95 |
| MonoisotopicMass | 473.012252 |
| CLogP | 5.048 |
| CLogS | -7.688 |
| H Acceptors | 3 |
| TotalSurfaceArea | 334.12 |
| Relative PSA | 0.21573 |
| PolarSurfaceArea | 86.93 |
| Druglikeness | 1.3228 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.51613 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Amides | 1 |
| StereoCon |
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1 - (5Z)-5-[[5-chloro-2-[(2-fluorophenyl)methoxy]phenyl]methylidene]-3-(3-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-5-[[5-chloro-2-[(2-fluorophenyl)methoxy]phenyl]methylidene]-3-(3-fluorophenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
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