(1S)-1-phenyl-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
Formula:C22H14N2O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(1S)-1-phenyl-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione is a drug-like molecule.
| MolName | (1S)-1-phenyl-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione |
| MolecularFormula | C22H14N2O3 |
| Smiles | O=C(C(Oc1c2cccc1)=C([C@@H]1c3ccccc3)C2=O)N1c1ncccc1 |
| InChI | InChI=1S/C22H14N2O3/c25-20-15-10-4-5-11-16(15)27-21-18(20)19(14-8-2-1-3-9-14)24(22(21)26)17-12-6-7-13-23-17/h1-13,19H/t19-/m0/s1 |
| InChIK | GIRYGRPCVLYOSO-IBGZPJMESA-N |
| TotalMolweight | 354.364 |
| Molweight | 354.364 |
| MonoisotopicMass | 354.100443 |
| CLogP | 3.3083 |
| CLogS | -4.658 |
| H Acceptors | 5 |
| TotalSurfaceArea | 255.76 |
| Relative PSA | 0.19784 |
| PolarSurfaceArea | 59.5 |
| Druglikeness | 2.6612 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.40741 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| StereoCenters | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon | this enantiomer |
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1 - (1S)-1-phenyl-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione | 2 - (1S)-1-phenyl-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
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