2-(3-bromophenoxy)-N-[(Z)-[5-(4-chlorophenyl)furan-2-yl]methylideneamino]acetamide
Formula:C19H14N2O3BrCl
Mutagenic:high
Tumorigenic:high
Reproductive Effective:low
2-(3-bromophenoxy)-N-[(Z)-[5-(4-chlorophenyl)furan-2-yl]methylideneamino]acetamide is not a drug-like molecule.
| MolName | 2-(3-bromophenoxy)-N-[(Z)-[5-(4-chlorophenyl)furan-2-yl]methylideneamino]acetamide |
| MolecularFormula | C19H14N2O3BrCl |
| Smiles | O=C(COc1cccc(Br)c1)N/N=C\c1ccc(-c(cc2)ccc2Cl)o1 |
| InChI | InChI=1S/C19H14BrClN2O3/c20-14-2-1-3-16(10-14)25-12-19(24)23-22-11-17-8-9-18(26-17)13-4-6-15(21)7-5-13/h1-11H,12H2,(H,23,24) |
| InChIK | HELPECLYXNZVOR-UHFFFAOYSA-N |
| TotalMolweight | 433.688 |
| Molweight | 433.688 |
| MonoisotopicMass | 431.987631 |
| CLogP | 5.0466 |
| CLogS | -6.531 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 294.25 |
| Relative PSA | 0.20432 |
| PolarSurfaceArea | 63.83 |
| Druglikeness | 4.6437 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | low |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.69231 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| StereoCon |
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