(1R)-1-(3-fluorophenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
Formula:C22H13N2O3F
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(1R)-1-(3-fluorophenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione is a drug-like molecule.
| MolName | (1R)-1-(3-fluorophenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione |
| MolecularFormula | C22H13N2O3F |
| Smiles | O=C(C(Oc1c2cccc1)=C([C@H]1c3cccc(F)c3)C2=O)N1c1ncccc1 |
| InChI | InChI=1S/C22H13FN2O3/c23-14-7-5-6-13(12-14)19-18-20(26)15-8-1-2-9-16(15)28-21(18)22(27)25(19)17-10-3-4-11-24-17/h1-12,19H/t19-/m1/s1 |
| InChIK | NYNZKPUOVGUQJP-LJQANCHMSA-N |
| TotalMolweight | 372.354 |
| Molweight | 372.354 |
| MonoisotopicMass | 372.091021 |
| CLogP | 3.4091 |
| CLogS | -4.972 |
| H Acceptors | 5 |
| TotalSurfaceArea | 262.11 |
| Relative PSA | 0.19305 |
| PolarSurfaceArea | 59.5 |
| Druglikeness | 1.3212 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.39286 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| StereoCenters | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon | this enantiomer |
Click to Load Molecule:
1 - (1R)-1-(3-fluorophenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione | 2 - (1R)-1-(3-fluorophenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off