N-[(Z)-(2-chlorophenyl)methylideneamino]-2-(hydroxymethyl)benzamide
Formula:C15H13N2O2Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(2-chlorophenyl)methylideneamino]-2-(hydroxymethyl)benzamide is a drug-like molecule.
| MolName | N-[(Z)-(2-chlorophenyl)methylideneamino]-2-(hydroxymethyl)benzamide |
| MolecularFormula | C15H13N2O2Cl |
| Smiles | OCc(cccc1)c1C(N/N=C\c(cccc1)c1Cl)=O |
| InChI | InChI=1S/C15H13ClN2O2/c16-14-8-4-2-5-11(14)9-17-18-15(20)13-7-3-1-6-12(13)10-19/h1-9,19H,10H2,(H,18,20) |
| InChIK | CUQPHRWCXNDORP-UHFFFAOYSA-N |
| TotalMolweight | 288.733 |
| Molweight | 288.733 |
| MonoisotopicMass | 288.066555 |
| CLogP | 3.2103 |
| CLogS | -4.341 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 222.52 |
| Relative PSA | 0.2207 |
| PolarSurfaceArea | 61.69 |
| Druglikeness | 4.297 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| StereoCon |
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