rel-(3R,4R)-N-[(3,4-dimethylphenyl)methyl]-4-(methoxymethyl)-1-(pyrimidin-2-yl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-N-[(3,4-dimethylphenyl)methyl]-4-(methoxymethyl)-1-(pyrimidin-2-yl)pyrrolidine-3-carboxamide
rel-(3R,4R)-N-[(3,4-dimethylphenyl)methyl]-4-(methoxymethyl)-1-(pyrimidin-2-yl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-1757 |
| Compound Name: | rel-(3R,4R)-N-[(3,4-dimethylphenyl)methyl]-4-(methoxymethyl)-1-(pyrimidin-2-yl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 354.45 |
| Molecular Formula: | C20 H26 N4 O2 |
| Smiles: | Cc1ccc(CNC([C@@H]2CN(C[C@H]2COC)c2ncccn2)=O)cc1C |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.7347 |
| logD: | 2.7346 |
| logSw: | -3.0633 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.123 |
| InChI Key: | OLJHFWHSXLYDKI-MSOLQXFVSA-N |