rel-(3R,4S)-N-methyl-4-[2-(3-methyl-1H-pyrazol-1-yl)acetamido]-1-[(pyridin-3-yl)methyl]pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4S)-N-methyl-4-[2-(3-methyl-1H-pyrazol-1-yl)acetamido]-1-[(pyridin-3-yl)methyl]pyrrolidine-3-carboxamide
rel-(3R,4S)-N-methyl-4-[2-(3-methyl-1H-pyrazol-1-yl)acetamido]-1-[(pyridin-3-yl)methyl]pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S963-3330 |
| Compound Name: | rel-(3R,4S)-N-methyl-4-[2-(3-methyl-1H-pyrazol-1-yl)acetamido]-1-[(pyridin-3-yl)methyl]pyrrolidine-3-carboxamide |
| Molecular Weight: | 356.43 |
| Molecular Formula: | C18 H24 N6 O2 |
| Smiles: | Cc1ccn(CC(N[C@H]2CN(Cc3cccnc3)C[C@@H]2C(NC)=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -1.3856 |
| logD: | -2.1038 |
| logSw: | -1.4062 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.147 |
| InChI Key: | KEFXYNQXLZRMRC-HOTGVXAUSA-N |