2-[(Z)-(2-anilino-2-oxoethylidene)amino]oxy-N-[2-(4-chlorophenyl)ethyl]acetamide
Formula:C18H18N3O3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(Z)-(2-anilino-2-oxoethylidene)amino]oxy-N-[2-(4-chlorophenyl)ethyl]acetamide is a drug-like molecule.
| MolName | 2-[(Z)-(2-anilino-2-oxoethylidene)amino]oxy-N-[2-(4-chlorophenyl)ethyl]acetamide |
| MolecularFormula | C18H18N3O3Cl |
| Smiles | O=C(CO/N=C\C(Nc1ccccc1)=O)NCCc(cc1)ccc1Cl |
| InChI | InChI=1S/C18H18ClN3O3/c19-15-8-6-14(7-9-15)10-11-20-18(24)13-25-21-12-17(23)22-16-4-2-1-3-5-16/h1-9,12H,10-11,13H2,(H,20,24)(H,22,23) |
| InChIK | WSLOBDQYXYNIAG-UHFFFAOYSA-N |
| TotalMolweight | 359.812 |
| Molweight | 359.812 |
| MonoisotopicMass | 359.103669 |
| CLogP | 2.5869 |
| CLogS | -3.983 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 282.9 |
| Relative PSA | 0.24924 |
| PolarSurfaceArea | 79.79 |
| Druglikeness | 2.7553 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.76 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 8 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| Amides | 2 |
| StereoCon |
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1 - 2-[(Z)-(2-anilino-2-oxoethylidene)amino]oxy-N-[2-(4-chlorophenyl)ethyl]acetamide | 2 - 2-[(Z)-(2-anilino-2-oxoethylidene)amino]oxy-N-[2-(4-chlorophenyl)ethyl]acetamide
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