cyclobutyl[rel-(3aR,7aR)-2-[(2,5-dimethylphenyl)methyl]-3a-(hydroxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone
Chemical Structure Depiction of
cyclobutyl[rel-(3aR,7aR)-2-[(2,5-dimethylphenyl)methyl]-3a-(hydroxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone
cyclobutyl[rel-(3aR,7aR)-2-[(2,5-dimethylphenyl)methyl]-3a-(hydroxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone
Compound characteristics
| Compound ID: | CM2407-2930 |
| Compound Name: | cyclobutyl[rel-(3aR,7aR)-2-[(2,5-dimethylphenyl)methyl]-3a-(hydroxymethyl)octahydro-5H-pyrrolo[3,4-c]pyridin-5-yl]methanone |
| Molecular Weight: | 356.51 |
| Molecular Formula: | C22 H32 N2 O2 |
| Smiles: | Cc1ccc(C)c(CN2C[C@@H]3CCN(C[C@@]3(C2)CO)C(C2CCC2)=O)c1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.8613 |
| logD: | -0.9048 |
| logSw: | -2.6809 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.152 |
| InChI Key: | BBSXFNJXFWMKDH-IRLDBZIGSA-N |