N-[(Z)-[5-(3,4-dichlorophenyl)furan-2-yl]methylideneamino]-2-phenylacetamide
Formula:C19H14N2O2Cl2
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
N-[(Z)-[5-(3,4-dichlorophenyl)furan-2-yl]methylideneamino]-2-phenylacetamide is not a drug-like molecule.
| MolName | N-[(Z)-[5-(3,4-dichlorophenyl)furan-2-yl]methylideneamino]-2-phenylacetamide |
| MolecularFormula | C19H14N2O2Cl2 |
| Smiles | O=C(Cc1ccccc1)N/N=C\c1ccc(-c(cc2)cc(Cl)c2Cl)o1 |
| InChI | InChI=1S/C19H14Cl2N2O2/c20-16-8-6-14(11-17(16)21)18-9-7-15(25-18)12-22-23-19(24)10-13-4-2-1-3-5-13/h1-9,11-12H,10H2,(H,23,24) |
| InChIK | PEIMOCFVUQFVMB-UHFFFAOYSA-N |
| TotalMolweight | 373.238 |
| Molweight | 373.238 |
| MonoisotopicMass | 372.043232 |
| CLogP | 5.3506 |
| CLogS | -6.618 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 281.04 |
| Relative PSA | 0.17834 |
| PolarSurfaceArea | 54.6 |
| Druglikeness | 6.4874 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.68 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| StereoCon |
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