N-[(Z)-(3,4-dichlorophenyl)methylideneamino]-4-hydroxybenzamide
Formula:C14H10N2O2Cl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(3,4-dichlorophenyl)methylideneamino]-4-hydroxybenzamide is a drug-like molecule.
| MolName | N-[(Z)-(3,4-dichlorophenyl)methylideneamino]-4-hydroxybenzamide |
| MolecularFormula | C14H10N2O2Cl2 |
| Smiles | Oc(cc1)ccc1C(N/N=C\c(cc1)cc(Cl)c1Cl)=O |
| InChI | InChI=1S/C14H10Cl2N2O2/c15-12-6-1-9(7-13(12)16)8-17-18-14(20)10-2-4-11(19)5-3-10/h1-8,19H,(H,18,20) |
| InChIK | JKRPJOVYYZNJOR-UHFFFAOYSA-N |
| TotalMolweight | 309.151 |
| Molweight | 309.151 |
| MonoisotopicMass | 308.011932 |
| CLogP | 4.0679 |
| CLogS | -4.897 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 224.18 |
| Relative PSA | 0.21907 |
| PolarSurfaceArea | 61.69 |
| Druglikeness | 4.4298 |
| 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 | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| StereoCon |
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