rel-(3R,4R)-1-[(4-cyanophenyl)methyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-[(4-cyanophenyl)methyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
rel-(3R,4R)-1-[(4-cyanophenyl)methyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-3583 |
| Compound Name: | rel-(3R,4R)-1-[(4-cyanophenyl)methyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide |
| Molecular Weight: | 287.36 |
| Molecular Formula: | C16 H21 N3 O2 |
| Smiles: | CNC([C@@H]1CN(Cc2ccc(C#N)cc2)C[C@H]1COC)=O |
| Stereo: | RELATIVE |
| logP: | 0.5818 |
| logD: | -1.2818 |
| logSw: | -2.0151 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.519 |
| InChI Key: | AJXLXRHZPCTBIY-CABCVRRESA-N |