N-[(Z)-pyridin-4-ylmethylideneamino]-4-(quinolin-8-yloxymethyl)benzamide
Formula:C23H18N4O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-pyridin-4-ylmethylideneamino]-4-(quinolin-8-yloxymethyl)benzamide is a drug-like molecule.
| MolName | N-[(Z)-pyridin-4-ylmethylideneamino]-4-(quinolin-8-yloxymethyl)benzamide |
| MolecularFormula | C23H18N4O2 |
| Smiles | O=C(c1ccc(COc2cccc3cccnc23)cc1)N/N=C\c1ccncc1 |
| InChI | InChI=1S/C23H18N4O2/c28-23(27-26-15-17-10-13-24-14-11-17)20-8-6-18(7-9-20)16-29-21-5-1-3-19-4-2-12-25-22(19)21/h1-15H,16H2,(H,27,28) |
| InChIK | LPMIBQCIWHTMHC-UHFFFAOYSA-N |
| TotalMolweight | 382.422 |
| Molweight | 382.422 |
| MonoisotopicMass | 382.142976 |
| CLogP | 3.8648 |
| CLogS | -4.973 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 302.63 |
| Relative PSA | 0.22453 |
| PolarSurfaceArea | 76.47 |
| Druglikeness | 4.0205 |
| 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 | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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