2-chloro-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide
Formula:C18H18N3O2Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-chloro-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide is a drug-like molecule.
| MolName | 2-chloro-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide |
| MolecularFormula | C18H18N3O2Cl |
| Smiles | O=C(c(cccc1)c1Cl)N/N=C\c(cc1)ccc1N1CCOCC1 |
| InChI | InChI=1S/C18H18ClN3O2/c19-17-4-2-1-3-16(17)18(23)21-20-13-14-5-7-15(8-6-14)22-9-11-24-12-10-22/h1-8,13H,9-12H2,(H,21,23) |
| InChIK | QDZPYGFAHDXNBP-UHFFFAOYSA-N |
| TotalMolweight | 343.813 |
| Molweight | 343.813 |
| MonoisotopicMass | 343.108754 |
| CLogP | 3.4766 |
| CLogS | -4.56 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 264.25 |
| Relative PSA | 0.18755 |
| PolarSurfaceArea | 53.93 |
| Druglikeness | 5.1383 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 5 |
| Symmetricatoms | 4 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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1 - 2-chloro-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide | 2 - 2-chloro-N-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide
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