N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-4-hydroxybenzamide
Formula:C16H13N2O2Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-4-hydroxybenzamide is a drug-like molecule.
| MolName | N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-4-hydroxybenzamide |
| MolecularFormula | C16H13N2O2Cl |
| Smiles | Oc(cc1)ccc1C(N/N=C\C(\Cl)=C\c1ccccc1)=O |
| InChI | InChI=1S/C16H13ClN2O2/c17-14(10-12-4-2-1-3-5-12)11-18-19-16(21)13-6-8-15(20)9-7-13/h1-11,20H,(H,19,21) |
| InChIK | DJXLBJOTWUETDV-UHFFFAOYSA-N |
| TotalMolweight | 300.744 |
| Molweight | 300.744 |
| MonoisotopicMass | 300.066555 |
| CLogP | 3.3358 |
| CLogS | -4.408 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 233.47 |
| Relative PSA | 0.21035 |
| PolarSurfaceArea | 61.69 |
| Druglikeness | 4.6382 |
| 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 | 21 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| StereoCon |
Click to Load Molecule:
1 - N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-4-hydroxybenzamide | 2 - N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-4-hydroxybenzamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off