N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide
Formula:C15H14N2O2
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide is a drug-like molecule.
| MolName | N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-phenylacetamide |
| MolecularFormula | C15H14N2O2 |
| Smiles | O=C(Cc1ccccc1)N/N=C\C=C\c1ccco1 |
| InChI | InChI=1S/C15H14N2O2/c18-15(12-13-6-2-1-3-7-13)17-16-10-4-8-14-9-5-11-19-14/h1-11H,12H2,(H,17,18) |
| InChIK | KNVAREUGKDGMHT-UHFFFAOYSA-N |
| TotalMolweight | 254.288 |
| Molweight | 254.288 |
| MonoisotopicMass | 254.105528 |
| CLogP | 2.4067 |
| CLogS | -3.66 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 216.94 |
| Relative PSA | 0.23103 |
| PolarSurfaceArea | 54.6 |
| Druglikeness | 4.2339 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.73684 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| StereoCon |
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