N-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]-3-hydroxynaphthalene-2-carboxamide
Formula:C19H14N2O3F2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]-3-hydroxynaphthalene-2-carboxamide is a drug-like molecule.
| MolName | N-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]-3-hydroxynaphthalene-2-carboxamide |
| MolecularFormula | C19H14N2O3F2 |
| Smiles | Oc1cc2ccccc2cc1C(N/N=C\c(cc1)ccc1OC(F)F)=O |
| InChI | InChI=1S/C19H14F2N2O3/c20-19(21)26-15-7-5-12(6-8-15)11-22-23-18(25)16-9-13-3-1-2-4-14(13)10-17(16)24/h1-11,19,24H,(H,23,25) |
| InChIK | WBSNUUQHAWMNSK-UHFFFAOYSA-N |
| TotalMolweight | 356.327 |
| Molweight | 356.327 |
| MonoisotopicMass | 356.097249 |
| CLogP | 4.2197 |
| CLogS | -5.653 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 263.14 |
| Relative PSA | 0.22463 |
| PolarSurfaceArea | 70.92 |
| Druglikeness | 1.4985 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.65385 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Sp3Atoms | 3 |
| Symmetricatoms | 3 |
| StereoCon |
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