N-[(Z)-(4-bromophenyl)methylideneamino]-2-(2-chlorophenoxy)acetamide
Formula:C15H12N2O2BrCl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(4-bromophenyl)methylideneamino]-2-(2-chlorophenoxy)acetamide is a drug-like molecule.
| MolName | N-[(Z)-(4-bromophenyl)methylideneamino]-2-(2-chlorophenoxy)acetamide |
| MolecularFormula | C15H12N2O2BrCl |
| Smiles | O=C(COc(cccc1)c1Cl)N/N=C\c(cc1)ccc1Br |
| InChI | InChI=1S/C15H12BrClN2O2/c16-12-7-5-11(6-8-12)9-18-19-15(20)10-21-14-4-2-1-3-13(14)17/h1-9H,10H2,(H,19,20) |
| InChIK | PWNOOXPXEYLUJZ-UHFFFAOYSA-N |
| TotalMolweight | 367.629 |
| Molweight | 367.629 |
| MonoisotopicMass | 365.977066 |
| CLogP | 4.1077 |
| CLogS | -5.071 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 244.8 |
| Relative PSA | 0.18795 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | 2.4378 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | low |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| StereoCon |
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