2-(2,3-dichlorophenoxy)-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide
Formula:C13H10N2O2Cl2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
2-(2,3-dichlorophenoxy)-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide is a drug-like molecule.
| MolName | 2-(2,3-dichlorophenoxy)-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide |
| MolecularFormula | C13H10N2O2Cl2S |
| Smiles | O=C(COc1cccc(Cl)c1Cl)N/N=C\c1cccs1 |
| InChI | InChI=1S/C13H10Cl2N2O2S/c14-10-4-1-5-11(13(10)15)19-8-12(18)17-16-7-9-3-2-6-20-9/h1-7H,8H2,(H,17,18) |
| InChIK | CZQKPPQTRKAHDJ-UHFFFAOYSA-N |
| TotalMolweight | 329.206 |
| Molweight | 329.206 |
| MonoisotopicMass | 327.984002 |
| CLogP | 3.8551 |
| CLogS | -4.983 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 237.53 |
| Relative PSA | 0.27942 |
| PolarSurfaceArea | 78.93 |
| Druglikeness | 5.8831 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | high |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.65 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 2 |
| StereoCon |
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1 - 2-(2,3-dichlorophenoxy)-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide | 2 - 2-(2,3-dichlorophenoxy)-N-[(Z)-thiophen-2-ylmethylideneamino]acetamide
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