4-fluoro-N-(7-hydroxy-2-oxochromen-3-yl)benzamide
Formula:C16H10NO4F
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
4-fluoro-N-(7-hydroxy-2-oxochromen-3-yl)benzamide is a drug-like molecule.
| MolName | 4-fluoro-N-(7-hydroxy-2-oxochromen-3-yl)benzamide |
| MolecularFormula | C16H10NO4F |
| Smiles | Oc(cc1)cc(OC2=O)c1C=C2NC(c(cc1)ccc1F)=O |
| InChI | InChI=1S/C16H10FNO4/c17-11-4-1-9(2-5-11)15(20)18-13-7-10-3-6-12(19)8-14(10)22-16(13)21/h1-8,19H,(H,18,20) |
| InChIK | KTXMHRHFMHWBRA-UHFFFAOYSA-N |
| TotalMolweight | 299.256 |
| Molweight | 299.256 |
| MonoisotopicMass | 299.059387 |
| CLogP | 2.2069 |
| CLogS | -3.763 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 213.89 |
| Relative PSA | 0.28351 |
| PolarSurfaceArea | 75.63 |
| Druglikeness | 1.1192 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.63636 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| 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 - 4-fluoro-N-(7-hydroxy-2-oxochromen-3-yl)benzamide | 2 - 4-fluoro-N-(7-hydroxy-2-oxochromen-3-yl)benzamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off