| MolName | (3R)-5-chloro-1-[(2-chlorophenyl)methyl]-3-hydroxy-3-(1H-indol-3-yl)indol-2-one |
| MolecularFormula | C23H16N2O2Cl2 |
| Smiles | O[C@](c1c[nH]c2c1cccc2)(c(cc(cc1)Cl)c1N1Cc(cccc2)c2Cl)C1=O |
| InChI | InChI=1S/C23H16Cl2N2O2/c24-15-9-10-21-17(11-15)23(29,18-12-26-20-8-4-2-6-16(18)20)22(28)27(21)13-14-5-1-3-7-19(14)25/h1-12,26,29H,13H2/t23-/m0/s1 |
| InChIK | JYAJRIRVAAEMRO-QHCPKHFHSA-N |
| TotalMolweight | 423.298 |
| Molweight | 423.298 |
| MonoisotopicMass | 422.058882 |
| CLogP | 4.3407 |
| CLogS | -6.044 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 292.86 |
| Relative PSA | 0.14915 |
| PolarSurfaceArea | 56.33 |
| Druglikeness | 4.6804 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.44828 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| StereoCenters | 1 |
| Rotatable Bond | 3 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 21 |
| Sp3Atoms | 3 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon | this enantiomer |
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1 - (3R)-5-chloro-1-[(2-chlorophenyl)methyl]-3-hydroxy-3-(1H-indol-3-yl)indol-2-one | 2 - (3R)-5-chloro-1-[(2-chlorophenyl)methyl]-3-hydroxy-3-(1H-indol-3-yl)indol-2-one