(5Z)-5-[[3-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Formula:C14H8N2O2S4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(5Z)-5-[[3-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.
| MolName | (5Z)-5-[[3-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| MolecularFormula | C14H8N2O2S4 |
| Smiles | O=C(/C(/S1)=C/c2cccc(/C=C(/C(N3)=O)\SC3=S)c2)NC1=S |
| InChI | InChI=1S/C14H8N2O2S4/c17-11-9(21-13(19)15-11)5-7-2-1-3-8(4-7)6-10-12(18)16-14(20)22-10/h1-6H,(H,15,17,19)(H,16,18,20) |
| InChIK | AYGXCXUMHDVVJU-UHFFFAOYSA-N |
| TotalMolweight | 364.494 |
| Molweight | 364.494 |
| MonoisotopicMass | 363.946858 |
| CLogP | 0.6288 |
| CLogS | -5.384 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 254.5 |
| Relative PSA | 0.55002 |
| PolarSurfaceArea | 172.98 |
| Druglikeness | 2.3511 |
| 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 | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 4 |
| Symmetricatoms | 10 |
| Amides | 2 |
| StereoCon |
Click to Load Molecule:
1 - (5Z)-5-[[3-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-5-[[3-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
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