N-[(Z)-furan-2-ylmethylideneamino]-2,2-diphenylcyclopropane-1-carboxamide
Formula:C21H18N2O2
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-furan-2-ylmethylideneamino]-2,2-diphenylcyclopropane-1-carboxamide is a drug-like molecule.
| MolName | N-[(Z)-furan-2-ylmethylideneamino]-2,2-diphenylcyclopropane-1-carboxamide |
| MolecularFormula | C21H18N2O2 |
| Smiles | O=C(C(C1)C1(c1ccccc1)c1ccccc1)N/N=C\c1ccco1 |
| InChI | InChI=1S/C21H18N2O2/c24-20(23-22-15-18-12-7-13-25-18)19-14-21(19,16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-13,15,19H,14H2,(H,23,24)/t19-/m1/s1 |
| InChIK | QFKVHBBXWLVKKI-LJQANCHMSA-N |
| TotalMolweight | 330.386 |
| Molweight | 330.386 |
| MonoisotopicMass | 330.136828 |
| CLogP | 3.9965 |
| CLogS | -4.384 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 259.61 |
| Relative PSA | 0.19306 |
| PolarSurfaceArea | 54.6 |
| Druglikeness | 5.4222 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.52 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| StereoCenters | 1 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 3 |
| Symmetricatoms | 8 |
| StereoCon | racemate |
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1 - N-[(Z)-furan-2-ylmethylideneamino]-2,2-diphenylcyclopropane-1-carboxamide | 2 - N-[(Z)-furan-2-ylmethylideneamino]-2,2-diphenylcyclopropane-1-carboxamide
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