N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-2-(3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-2-(3,5-dimethyl-1H-pyrazol-1-yl)acetamide
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-2-(3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | S639-1341 |
| Compound Name: | N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-2-(3,5-dimethyl-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 370.5 |
| Molecular Formula: | C20 H30 N6 O |
| Smiles: | Cc1cc(C)n(CC(N[C@@H]2CN(Cc3ccccn3)C[C@H]2CN(C)C)=O)n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.3534 |
| logD: | -2.4777 |
| logSw: | -1.784 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.764 |
| InChI Key: | BTPOCXKGHXAUPQ-HKUYNNGSSA-N |