N-[(5Z)-5-[(3-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetamide
Formula:C18H14N2O3S2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
N-[(5Z)-5-[(3-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetamide is a drug-like molecule.
| MolName | N-[(5Z)-5-[(3-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetamide |
| MolecularFormula | C18H14N2O3S2 |
| Smiles | Oc1cccc(/C=C(/C(N2NC(Cc3ccccc3)=O)=O)\SC2=S)c1 |
| InChI | InChI=1S/C18H14N2O3S2/c21-14-8-4-7-13(9-14)10-15-17(23)20(18(24)25-15)19-16(22)11-12-5-2-1-3-6-12/h1-10,21H,11H2,(H,19,22) |
| InChIK | TZBKAEWFLHXIIN-UHFFFAOYSA-N |
| TotalMolweight | 370.452 |
| Molweight | 370.452 |
| MonoisotopicMass | 370.044583 |
| CLogP | 1.1236 |
| CLogS | -4.353 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 271.8 |
| Relative PSA | 0.36674 |
| PolarSurfaceArea | 127.03 |
| Druglikeness | 4.0102 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - N-[(5Z)-5-[(3-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetamide | 2 - N-[(5Z)-5-[(3-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetamide
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