N-(7-hydroxy-2-oxochromen-3-yl)benzamide
Formula:C16H11NO4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-(7-hydroxy-2-oxochromen-3-yl)benzamide is a drug-like molecule.
| MolName | N-(7-hydroxy-2-oxochromen-3-yl)benzamide |
| MolecularFormula | C16H11NO4 |
| Smiles | Oc(cc1)cc(OC2=O)c1C=C2NC(c1ccccc1)=O |
| InChI | InChI=1S/C16H11NO4/c18-12-7-6-11-8-13(16(20)21-14(11)9-12)17-15(19)10-4-2-1-3-5-10/h1-9,18H,(H,17,19) |
| InChIK | VYNNYDYTRZLFQK-UHFFFAOYSA-N |
| TotalMolweight | 281.266 |
| Molweight | 281.266 |
| MonoisotopicMass | 281.068809 |
| CLogP | 2.1061 |
| CLogS | -3.449 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 207.54 |
| Relative PSA | 0.29218 |
| PolarSurfaceArea | 75.63 |
| Druglikeness | 2.4592 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61905 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - N-(7-hydroxy-2-oxochromen-3-yl)benzamide | 2 - N-(7-hydroxy-2-oxochromen-3-yl)benzamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off