rel-(3aR,7aS)-2-[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]hexahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
rel-(3aR,7aS)-2-[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]hexahydro-1H-isoindole-1,3(2H)-dione
rel-(3aR,7aS)-2-[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]hexahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | Y502-8671 |
| Compound Name: | rel-(3aR,7aS)-2-[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]hexahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 385.46 |
| Molecular Formula: | C24 H23 N3 O2 |
| Smiles: | [H][C@@]12CCCC[C@@]2([H])C(N(Cc2cn(c3ccccc3)nc2c2ccccc2)C1=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.8274 |
| logD: | 3.8274 |
| logSw: | -4.0443 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.316 |
| InChI Key: | LODNEMXRJLSGDQ-SFTDATJTSA-N |