2-(7-hydroxy-2-oxochromen-4-yl)acetamide
Formula:C11H9NO4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
2-(7-hydroxy-2-oxochromen-4-yl)acetamide is a drug-like molecule.
| MolName | 2-(7-hydroxy-2-oxochromen-4-yl)acetamide |
| MolecularFormula | C11H9NO4 |
| Smiles | NC(CC(c(ccc(O)c1)c1O1)=CC1=O)=O |
| InChI | InChI=1S/C11H9NO4/c12-10(14)3-6-4-11(15)16-9-5-7(13)1-2-8(6)9/h1-2,4-5,13H,3H2,(H2,12,14) |
| InChIK | YXBOCMCJTKIUAP-UHFFFAOYSA-N |
| TotalMolweight | 219.195 |
| Molweight | 219.195 |
| MonoisotopicMass | 219.053159 |
| CLogP | 0.0102 |
| CLogS | -1.624 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 158.6 |
| Relative PSA | 0.40637 |
| PolarSurfaceArea | 89.62 |
| Druglikeness | -1.4643 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5625 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 3 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - 2-(7-hydroxy-2-oxochromen-4-yl)acetamide | 2 - 2-(7-hydroxy-2-oxochromen-4-yl)acetamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off