2-(2-chloro-6-fluorophenyl)-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]acetamide
Chemical Structure Depiction of
2-(2-chloro-6-fluorophenyl)-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]acetamide
2-(2-chloro-6-fluorophenyl)-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]acetamide
Compound characteristics
| Compound ID: | S639-3349 |
| Compound Name: | 2-(2-chloro-6-fluorophenyl)-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]acetamide |
| Molecular Weight: | 391.89 |
| Molecular Formula: | C16 H23 Cl F N3 O3 S |
| Smiles: | CN(C)C[C@@H]1CN(C[C@H]1NC(Cc1c(cccc1[Cl])F)=O)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0718 |
| logD: | -0.9104 |
| logSw: | -2.6873 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.957 |
| InChI Key: | ZEAXXVZCAAYTRB-NHYWBVRUSA-N |