2-(2-chloro-6-fluorophenyl)-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]acetamide
Chemical Structure Depiction of
2-(2-chloro-6-fluorophenyl)-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]acetamide
2-(2-chloro-6-fluorophenyl)-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]acetamide
Compound characteristics
| Compound ID: | S639-0576 |
| Compound Name: | 2-(2-chloro-6-fluorophenyl)-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]acetamide |
| Molecular Weight: | 391.87 |
| Molecular Formula: | C19 H23 Cl F N5 O |
| Smiles: | CN(C)C[C@@H]1CN(C[C@H]1NC(Cc1c(cccc1[Cl])F)=O)c1ccncn1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.196 |
| logD: | -0.0003 |
| logSw: | -2.9444 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.588 |
| InChI Key: | VBXMHMBVLCIFDF-GUYCJALGSA-N |