N-[(Z)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]furan-2-carboxamide
Formula:C19H15N2O3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]furan-2-carboxamide is a drug-like molecule.
| MolName | N-[(Z)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]furan-2-carboxamide |
| MolecularFormula | C19H15N2O3Cl |
| Smiles | O=C(c1ccco1)N/N=C\c(cc1)ccc1OCc(cc1)ccc1Cl |
| InChI | InChI=1S/C19H15ClN2O3/c20-16-7-3-15(4-8-16)13-25-17-9-5-14(6-10-17)12-21-22-19(23)18-2-1-11-24-18/h1-12H,13H2,(H,22,23) |
| InChIK | CDPCBKFIUOVLQA-UHFFFAOYSA-N |
| TotalMolweight | 354.792 |
| Molweight | 354.792 |
| MonoisotopicMass | 354.07712 |
| CLogP | 4.3444 |
| CLogS | -5.48 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 275.62 |
| Relative PSA | 0.21813 |
| PolarSurfaceArea | 63.83 |
| Druglikeness | 4.269 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.72 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| StereoCon |
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