2-(4-cyanophenoxy)-N-[(Z)-(3-phenoxyphenyl)methylideneamino]acetamide
Formula:C22H17N3O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-(4-cyanophenoxy)-N-[(Z)-(3-phenoxyphenyl)methylideneamino]acetamide is a drug-like molecule.
| MolName | 2-(4-cyanophenoxy)-N-[(Z)-(3-phenoxyphenyl)methylideneamino]acetamide |
| MolecularFormula | C22H17N3O3 |
| Smiles | N#Cc(cc1)ccc1OCC(N/N=C\c1cc(Oc2ccccc2)ccc1)=O |
| InChI | InChI=1S/C22H17N3O3/c23-14-17-9-11-19(12-10-17)27-16-22(26)25-24-15-18-5-4-8-21(13-18)28-20-6-2-1-3-7-20/h1-13,15H,16H2,(H,25,26) |
| InChIK | UKTXRTURXOJYLN-UHFFFAOYSA-N |
| TotalMolweight | 371.395 |
| Molweight | 371.395 |
| MonoisotopicMass | 371.126992 |
| CLogP | 4.0077 |
| CLogS | -6.571 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 302.22 |
| Relative PSA | 0.2302 |
| PolarSurfaceArea | 83.71 |
| Druglikeness | -0.083437 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| StereoCon |
Click to Load Molecule:
1 - 2-(4-cyanophenoxy)-N-[(Z)-(3-phenoxyphenyl)methylideneamino]acetamide | 2 - 2-(4-cyanophenoxy)-N-[(Z)-(3-phenoxyphenyl)methylideneamino]acetamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off