N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-1-ethyl-5-methyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-1-ethyl-5-methyl-1H-pyrazole-4-carboxamide
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-1-ethyl-5-methyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | S639-8606 |
| Compound Name: | N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-1-ethyl-5-methyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 370.5 |
| Molecular Formula: | C20 H30 N6 O |
| Smiles: | CCn1c(C)c(cn1)C(N[C@@H]1CN(Cc2ccccn2)C[C@H]1CN(C)C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.5704 |
| logD: | -1.4963 |
| logSw: | -2.057 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.896 |
| InChI Key: | HXRPXAFFVDQNBL-LPHOPBHVSA-N |