2-(4-chlorophenyl)-N-[(Z)-[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]acetamide
Formula:C26H21N2O2Cl
Mutagenic:low
Tumorigenic:high
Reproductive Effective:none
2-(4-chlorophenyl)-N-[(Z)-[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]acetamide is not a drug-like molecule.
| MolName | 2-(4-chlorophenyl)-N-[(Z)-[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]acetamide |
| MolecularFormula | C26H21N2O2Cl |
| Smiles | O=C(Cc(cc1)ccc1Cl)N/N=C\c(cccc1)c1OCc1cccc2ccccc12 |
| InChI | InChI=1S/C26H21ClN2O2/c27-23-14-12-19(13-15-23)16-26(30)29-28-17-21-7-2-4-11-25(21)31-18-22-9-5-8-20-6-1-3-10-24(20)22/h1-15,17H,16,18H2,(H,29,30) |
| InChIK | XMYURCIUQXMRIX-UHFFFAOYSA-N |
| TotalMolweight | 428.918 |
| Molweight | 428.918 |
| MonoisotopicMass | 428.129155 |
| CLogP | 6.3482 |
| CLogS | -7.369 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 334.29 |
| Relative PSA | 0.13763 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | 4.0496 |
| Mutagenic | low |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.6129 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 7 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| StereoCon |
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