2-naphthalen-2-yloxy-N-[4-(4-nitrophenyl)phenyl]acetamide
Formula:C24H18N2O4
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
2-naphthalen-2-yloxy-N-[4-(4-nitrophenyl)phenyl]acetamide is a drug-like molecule.
| MolName | 2-naphthalen-2-yloxy-N-[4-(4-nitrophenyl)phenyl]acetamide |
| MolecularFormula | C24H18N2O4 |
| Smiles | [O-][N+](c(cc1)ccc1-c(cc1)ccc1NC(COc1cc2ccccc2cc1)=O)=O |
| InChI | InChI=1S/C24H18N2O4/c27-24(16-30-23-14-9-17-3-1-2-4-20(17)15-23)25-21-10-5-18(6-11-21)19-7-12-22(13-8-19)26(28)29/h1-15H,16H2,(H,25,27) |
| InChIK | VAJSCUZURVVXDL-UHFFFAOYSA-N |
| TotalMolweight | 398.417 |
| Molweight | 398.417 |
| MonoisotopicMass | 398.126658 |
| CLogP | 4.314 |
| CLogS | -7.06 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 304.02 |
| Relative PSA | 0.21354 |
| PolarSurfaceArea | 84.15 |
| Druglikeness | -4.4153 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | aromatic nitro |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| Amides | 1 |
| AcidicOxygens | 1 |
| StereoCon |
Click to Load Molecule:
1 - 2-naphthalen-2-yloxy-N-[4-(4-nitrophenyl)phenyl]acetamide | 2 - 2-naphthalen-2-yloxy-N-[4-(4-nitrophenyl)phenyl]acetamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off