N-[1-[(Z)-benzylideneamino]-4-phenylimidazol-2-yl]-2-(4-chlorophenoxy)acetamide
Formula:C24H19N4O2Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
N-[1-[(Z)-benzylideneamino]-4-phenylimidazol-2-yl]-2-(4-chlorophenoxy)acetamide is not a drug-like molecule.
| MolName | N-[1-[(Z)-benzylideneamino]-4-phenylimidazol-2-yl]-2-(4-chlorophenoxy)acetamide |
| MolecularFormula | C24H19N4O2Cl |
| Smiles | O=C(COc(cc1)ccc1Cl)Nc1nc(-c2ccccc2)cn1/N=C\c1ccccc1 |
| InChI | InChI=1S/C24H19ClN4O2/c25-20-11-13-21(14-12-20)31-17-23(30)28-24-27-22(19-9-5-2-6-10-19)16-29(24)26-15-18-7-3-1-4-8-18/h1-16H,17H2,(H,27,28,30) |
| InChIK | BXUFXLYYXXVEEA-UHFFFAOYSA-N |
| TotalMolweight | 430.894 |
| Molweight | 430.894 |
| MonoisotopicMass | 430.119653 |
| CLogP | 5.0667 |
| CLogS | -8.252 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 333.65 |
| Relative PSA | 0.19137 |
| PolarSurfaceArea | 68.51 |
| Druglikeness | 4.9102 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.54839 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 7 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 23 |
| Sp3Atoms | 2 |
| Symmetricatoms | 6 |
| Amides | 1 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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