N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]benzamide
Formula:C16H13N2OCl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]benzamide is a drug-like molecule.
| MolName | N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]benzamide |
| MolecularFormula | C16H13N2OCl |
| Smiles | O=C(c1ccccc1)N/N=C\C(\Cl)=C\c1ccccc1 |
| InChI | InChI=1S/C16H13ClN2O/c17-15(11-13-7-3-1-4-8-13)12-18-19-16(20)14-9-5-2-6-10-14/h1-12H,(H,19,20) |
| InChIK | CJPHEFNVIKTDDQ-UHFFFAOYSA-N |
| TotalMolweight | 284.745 |
| Molweight | 284.745 |
| MonoisotopicMass | 284.07164 |
| CLogP | 3.6815 |
| CLogS | -4.704 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 227.12 |
| Relative PSA | 0.15855 |
| PolarSurfaceArea | 41.46 |
| Druglikeness | 4.653 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 4 |
| StereoCon |
Click to Load Molecule:
1 - N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]benzamide | 2 - N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]benzamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off