rel-(3aR,7aS)-5-methyl-2-(quinolin-2-yl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
rel-(3aR,7aS)-5-methyl-2-(quinolin-2-yl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
rel-(3aR,7aS)-5-methyl-2-(quinolin-2-yl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 4333-1501 |
| Compound Name: | rel-(3aR,7aS)-5-methyl-2-(quinolin-2-yl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 292.34 |
| Molecular Formula: | C18 H16 N2 O2 |
| Smiles: | CC1C[C@@H]2C(N(C([C@@H]2CC=1)=O)c1ccc2ccccc2n1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.368 |
| logD: | 3.368 |
| logSw: | -3.5999 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.866 |
| InChI Key: | UFYYVRLKKCLXAZ-KBPBESRZSA-N |