2-(4-chlorophenoxy)-N-[(Z)-thiophen-3-ylmethylideneamino]acetamide
Formula:C13H11N2O2ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
2-(4-chlorophenoxy)-N-[(Z)-thiophen-3-ylmethylideneamino]acetamide is a drug-like molecule.
| MolName | 2-(4-chlorophenoxy)-N-[(Z)-thiophen-3-ylmethylideneamino]acetamide |
| MolecularFormula | C13H11N2O2ClS |
| Smiles | O=C(COc(cc1)ccc1Cl)N/N=C\c1cscc1 |
| InChI | InChI=1S/C13H11ClN2O2S/c14-11-1-3-12(4-2-11)18-8-13(17)16-15-7-10-5-6-19-9-10/h1-7,9H,8H2,(H,16,17) |
| InChIK | YLKMUBYSCUOVDF-UHFFFAOYSA-N |
| TotalMolweight | 294.761 |
| Molweight | 294.761 |
| MonoisotopicMass | 294.022975 |
| CLogP | 3.1669 |
| CLogS | -4.137 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 222.11 |
| Relative PSA | 0.29882 |
| PolarSurfaceArea | 78.93 |
| Druglikeness | 4.8145 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.73684 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - 2-(4-chlorophenoxy)-N-[(Z)-thiophen-3-ylmethylideneamino]acetamide | 2 - 2-(4-chlorophenoxy)-N-[(Z)-thiophen-3-ylmethylideneamino]acetamide
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