N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-3-methyl-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-3-methyl-1H-pyrazole-5-carboxamide
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-3-methyl-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | S639-0654 |
| Compound Name: | N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-3-methyl-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 329.4 |
| Molecular Formula: | C16 H23 N7 O |
| Smiles: | Cc1cc(C(N[C@@H]2CN(C[C@H]2CN(C)C)c2ccncn2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.4684 |
| logD: | -1.6702 |
| logSw: | -1.5428 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.369 |
| InChI Key: | KWUAZJYSVXCCQO-JSGCOSHPSA-N |