(1S)-7-chloro-1-(3-chlorophenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
Formula:C22H12N2O3Cl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
(1S)-7-chloro-1-(3-chlorophenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione is a drug-like molecule.
| MolName | (1S)-7-chloro-1-(3-chlorophenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione |
| MolecularFormula | C22H12N2O3Cl2 |
| Smiles | O=C(C(Oc(cc1)c2cc1Cl)=C([C@@H]1c3cc(Cl)ccc3)C2=O)N1c1ncccc1 |
| InChI | InChI=1S/C22H12Cl2N2O3/c23-13-5-3-4-12(10-13)19-18-20(27)15-11-14(24)7-8-16(15)29-21(18)22(28)26(19)17-6-1-2-9-25-17/h1-11,19H/t19-/m0/s1 |
| InChIK | QWNFSVLTMFOLJO-IBGZPJMESA-N |
| TotalMolweight | 423.254 |
| Molweight | 423.254 |
| MonoisotopicMass | 422.022497 |
| CLogP | 4.5203 |
| CLogS | -6.13 |
| H Acceptors | 5 |
| TotalSurfaceArea | 286.6 |
| Relative PSA | 0.17655 |
| PolarSurfaceArea | 59.5 |
| Druglikeness | 2.7235 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.41379 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| 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 - (1S)-7-chloro-1-(3-chlorophenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione | 2 - (1S)-7-chloro-1-(3-chlorophenyl)-2-pyridin-2-yl-1H-chromeno[2,3-c]pyrrole-3,9-dione
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