N-[(Z)-(4-piperidin-1-ylphenyl)methylideneamino]-2-quinolin-8-yloxyacetamide
Formula:C23H24N4O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(4-piperidin-1-ylphenyl)methylideneamino]-2-quinolin-8-yloxyacetamide is a drug-like molecule.
| MolName | N-[(Z)-(4-piperidin-1-ylphenyl)methylideneamino]-2-quinolin-8-yloxyacetamide |
| MolecularFormula | C23H24N4O2 |
| Smiles | O=C(COc1cccc2cccnc12)N/N=C\c(cc1)ccc1N1CCCCC1 |
| InChI | InChI=1S/C23H24N4O2/c28-22(17-29-21-8-4-6-19-7-5-13-24-23(19)21)26-25-16-18-9-11-20(12-10-18)27-14-2-1-3-15-27/h4-13,16H,1-3,14-15,17H2,(H,26,28) |
| InChIK | OOJHYPFSAMRDLT-UHFFFAOYSA-N |
| TotalMolweight | 388.47 |
| Molweight | 388.47 |
| MonoisotopicMass | 388.189926 |
| CLogP | 3.9255 |
| CLogS | -5.199 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 309.71 |
| Relative PSA | 0.19544 |
| PolarSurfaceArea | 66.82 |
| Druglikeness | 4.1654 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.65517 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Sp3Atoms | 7 |
| Symmetricatoms | 4 |
| Amines | 1 |
| Aromatic Amines | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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