| MolName | N-[(Z)-2,3-dihydroinden-1-ylideneamino]-4-(naphthalen-2-yloxymethyl)benzamide |
| MolecularFormula | C27H22N2O2 |
| Smiles | O=C(c1ccc(COc2cc3ccccc3cc2)cc1)N/N=C(/CC1)\c2c1cccc2 |
| InChI | InChI=1S/C27H22N2O2/c30-27(29-28-26-16-14-21-6-3-4-8-25(21)26)22-11-9-19(10-12-22)18-31-24-15-13-20-5-1-2-7-23(20)17-24/h1-13,15,17H,14,16,18H2,(H,29,30) |
| InChIK | APARAUGOFVQLEJ-UHFFFAOYSA-N |
| TotalMolweight | 406.484 |
| Molweight | 406.484 |
| MonoisotopicMass | 406.168128 |
| CLogP | 6.0748 |
| CLogS | -7.347 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 317.34 |
| Relative PSA | 0.14499 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | 2.0365 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.64516 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 5 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - N-[(Z)-2,3-dihydroinden-1-ylideneamino]-4-(naphthalen-2-yloxymethyl)benzamide | 2 - N-[(Z)-2,3-dihydroinden-1-ylideneamino]-4-(naphthalen-2-yloxymethyl)benzamide