N'-[(Z)-[4-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]-N-(2-phenylethyl)oxamide
Formula:C24H22N3O3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-[(Z)-[4-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]-N-(2-phenylethyl)oxamide is a drug-like molecule.
| MolName | N'-[(Z)-[4-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]-N-(2-phenylethyl)oxamide |
| MolecularFormula | C24H22N3O3Cl |
| Smiles | O=C(C(N/N=C\c(cc1)ccc1OCc(cccc1)c1Cl)=O)NCCc1ccccc1 |
| InChI | InChI=1S/C24H22ClN3O3/c25-22-9-5-4-8-20(22)17-31-21-12-10-19(11-13-21)16-27-28-24(30)23(29)26-15-14-18-6-2-1-3-7-18/h1-13,16H,14-15,17H2,(H,26,29)(H,28,30) |
| InChIK | JNWHHGQFBGVEEG-UHFFFAOYSA-N |
| TotalMolweight | 435.91 |
| Molweight | 435.91 |
| MonoisotopicMass | 435.134969 |
| CLogP | 4.2375 |
| CLogS | -5.53 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 342.66 |
| Relative PSA | 0.20577 |
| PolarSurfaceArea | 79.79 |
| Druglikeness | 3.8125 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide |
| Shape Index | 0.70968 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 9 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - N'-[(Z)-[4-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]-N-(2-phenylethyl)oxamide | 2 - N'-[(Z)-[4-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]-N-(2-phenylethyl)oxamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off