| MolName | (4Z)-2-(3-chlorophenyl)-4-[(5-morpholin-4-ylthiophen-2-yl)methylidene]-1,3-oxazol-5-one |
| MolecularFormula | C18H15N2O3ClS |
| Smiles | O=C1OC(c2cccc(Cl)c2)=N/C1=C\c1ccc(N2CCOCC2)s1 |
| InChI | InChI=1S/C18H15ClN2O3S/c19-13-3-1-2-12(10-13)17-20-15(18(22)24-17)11-14-4-5-16(25-14)21-6-8-23-9-7-21/h1-5,10-11H,6-9H2 |
| InChIK | QWIUWCUCIKKDEZ-UHFFFAOYSA-N |
| TotalMolweight | 374.847 |
| Molweight | 374.847 |
| MonoisotopicMass | 374.04919 |
| CLogP | 2.923 |
| CLogS | -4.918 |
| H Acceptors | 5 |
| TotalSurfaceArea | 268.15 |
| Relative PSA | 0.2553 |
| PolarSurfaceArea | 79.37 |
| Druglikeness | 3.3237 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 3 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 6 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - (4Z)-2-(3-chlorophenyl)-4-[(5-morpholin-4-ylthiophen-2-yl)methylidene]-1,3-oxazol-5-one | 2 - (4Z)-2-(3-chlorophenyl)-4-[(5-morpholin-4-ylthiophen-2-yl)methylidene]-1,3-oxazol-5-one