2-methyl-N-{rel-(3R,4S)-4-(methylcarbamoyl)-1-[(pyridin-3-yl)methyl]pyrrolidin-3-yl}pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-methyl-N-{rel-(3R,4S)-4-(methylcarbamoyl)-1-[(pyridin-3-yl)methyl]pyrrolidin-3-yl}pyrimidine-5-carboxamide
2-methyl-N-{rel-(3R,4S)-4-(methylcarbamoyl)-1-[(pyridin-3-yl)methyl]pyrrolidin-3-yl}pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | S963-3162 |
| Compound Name: | 2-methyl-N-{rel-(3R,4S)-4-(methylcarbamoyl)-1-[(pyridin-3-yl)methyl]pyrrolidin-3-yl}pyrimidine-5-carboxamide |
| Molecular Weight: | 354.41 |
| Molecular Formula: | C18 H22 N6 O2 |
| Smiles: | Cc1ncc(cn1)C(N[C@H]1CN(Cc2cccnc2)C[C@@H]1C(NC)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -1.5309 |
| logD: | -1.8446 |
| logSw: | -1.4227 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.121 |
| InChI Key: | RGGJAJHFZGXUBW-HOTGVXAUSA-N |