4-chloro-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-2-methoxybenzamide
Chemical Structure Depiction of
4-chloro-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-2-methoxybenzamide
4-chloro-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-2-methoxybenzamide
Compound characteristics
| Compound ID: | S639-0567 |
| Compound Name: | 4-chloro-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-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(c1ccc(cc1OC)[Cl])=O)c1ccncn1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.7409 |
| logD: | 0.6023 |
| logSw: | -3.4648 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.432 |
| InChI Key: | NDJZSXZGBINKKM-BBRMVZONSA-N |