N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-3-phenylpropanamide
Formula:C23H21N2O2Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-3-phenylpropanamide is not a drug-like molecule.
| MolName | N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-3-phenylpropanamide |
| MolecularFormula | C23H21N2O2Cl |
| Smiles | O=C(CCc1ccccc1)N/N=C\c(cccc1)c1OCc(cc1)ccc1Cl |
| InChI | InChI=1S/C23H21ClN2O2/c24-21-13-10-19(11-14-21)17-28-22-9-5-4-8-20(22)16-25-26-23(27)15-12-18-6-2-1-3-7-18/h1-11,13-14,16H,12,15,17H2,(H,26,27) |
| InChIK | GKFDAMVOLGWZJB-UHFFFAOYSA-N |
| TotalMolweight | 392.885 |
| Molweight | 392.885 |
| MonoisotopicMass | 392.129155 |
| CLogP | 5.6082 |
| CLogS | -6.033 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 313.45 |
| Relative PSA | 0.14679 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | 2.9149 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.67857 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 8 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| StereoCon |
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