N-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]-2-(2-prop-2-enylphenoxy)acetamide
Formula:C25H24N2O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]-2-(2-prop-2-enylphenoxy)acetamide is not a drug-like molecule.
| MolName | N-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]-2-(2-prop-2-enylphenoxy)acetamide |
| MolecularFormula | C25H24N2O3 |
| Smiles | C=CCc(cccc1)c1OCC(N/N=C\c1cc(OCc2ccccc2)ccc1)=O |
| InChI | InChI=1S/C25H24N2O3/c1-2-9-22-13-6-7-15-24(22)30-19-25(28)27-26-17-21-12-8-14-23(16-21)29-18-20-10-4-3-5-11-20/h2-8,10-17H,1,9,18-19H2,(H,27,28) |
| InChIK | XBCMZNUFKYQPND-UHFFFAOYSA-N |
| TotalMolweight | 400.477 |
| Molweight | 400.477 |
| MonoisotopicMass | 400.178693 |
| CLogP | 5.153 |
| CLogS | -5.554 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 332.57 |
| Relative PSA | 0.16842 |
| PolarSurfaceArea | 59.92 |
| Druglikeness | 1.4031 |
| 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 | 30 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 10 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 5 |
| Symmetricatoms | 2 |
| StereoCon |
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