2-(9H-fluoren-9-ylsulfanyl)-N-[(Z)-furan-2-ylmethylideneamino]acetamide
Formula:C20H16N2O2S
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
2-(9H-fluoren-9-ylsulfanyl)-N-[(Z)-furan-2-ylmethylideneamino]acetamide is a drug-like molecule.
| MolName | 2-(9H-fluoren-9-ylsulfanyl)-N-[(Z)-furan-2-ylmethylideneamino]acetamide |
| MolecularFormula | C20H16N2O2S |
| Smiles | O=C(CSC1c(cccc2)c2-c2c1cccc2)N/N=C\c1ccco1 |
| InChI | InChI=1S/C20H16N2O2S/c23-19(22-21-12-14-6-5-11-24-14)13-25-20-17-9-3-1-7-15(17)16-8-2-4-10-18(16)20/h1-12,20H,13H2,(H,22,23) |
| InChIK | HCOOLGSUSOMXLL-UHFFFAOYSA-N |
| TotalMolweight | 348.425 |
| Molweight | 348.425 |
| MonoisotopicMass | 348.093248 |
| CLogP | 3.9406 |
| CLogS | -7.62 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 266.69 |
| Relative PSA | 0.25352 |
| PolarSurfaceArea | 79.9 |
| Druglikeness | 5.6241 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.56 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 3 |
| Symmetricatoms | 6 |
| StereoCon |
Click to Load Molecule:
1 - 2-(9H-fluoren-9-ylsulfanyl)-N-[(Z)-furan-2-ylmethylideneamino]acetamide | 2 - 2-(9H-fluoren-9-ylsulfanyl)-N-[(Z)-furan-2-ylmethylideneamino]acetamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off