5-chloro-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-2-yl)pyrrolidin-3-yl]-2-methoxybenzamide
Chemical Structure Depiction of
5-chloro-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-2-yl)pyrrolidin-3-yl]-2-methoxybenzamide
5-chloro-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-2-yl)pyrrolidin-3-yl]-2-methoxybenzamide
Compound characteristics
| Compound ID: | S639-3644 |
| Compound Name: | 5-chloro-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-2-yl)pyrrolidin-3-yl]-2-methoxybenzamide |
| Molecular Weight: | 389.88 |
| Molecular Formula: | C19 H24 Cl N5 O2 |
| Smiles: | CN(C)C[C@@H]1CN(C[C@H]1NC(c1cc(ccc1OC)[Cl])=O)c1ncccn1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.6401 |
| logD: | 0.352 |
| logSw: | -3.4886 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.14 |
| InChI Key: | RKNHJMOVWKSNQK-BBRMVZONSA-N |