[rel-(3aR,4R,7aS)-4-hydroxyoctahydro-2H-isoindol-2-yl](1H-indol-5-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,4R,7aS)-4-hydroxyoctahydro-2H-isoindol-2-yl](1H-indol-5-yl)methanone
[rel-(3aR,4R,7aS)-4-hydroxyoctahydro-2H-isoindol-2-yl](1H-indol-5-yl)methanone
Compound characteristics
| Compound ID: | S890-0286 |
| Compound Name: | [rel-(3aR,4R,7aS)-4-hydroxyoctahydro-2H-isoindol-2-yl](1H-indol-5-yl)methanone |
| Molecular Weight: | 284.36 |
| Molecular Formula: | C17 H20 N2 O2 |
| Smiles: | [H][C@@]12CCC[C@H]([C@@]2([H])CN(C1)C(c1ccc2c(cc[nH]2)c1)=O)O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2085 |
| logD: | 1.2085 |
| logSw: | -2.2416 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.437 |
| InChI Key: | PXVYRJBYWROYSP-YCPHGPKFSA-N |