N-[rel-(3R,4S)-1-[(3-chloro-4-fluorophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]acetamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-[(3-chloro-4-fluorophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]acetamide
N-[rel-(3R,4S)-1-[(3-chloro-4-fluorophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]acetamide
Compound characteristics
| Compound ID: | S823-5018 |
| Compound Name: | N-[rel-(3R,4S)-1-[(3-chloro-4-fluorophenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]acetamide |
| Molecular Weight: | 300.76 |
| Molecular Formula: | C14 H18 Cl F N2 O2 |
| Smiles: | CC(N[C@@H]1CN(Cc2ccc(c(c2)[Cl])F)C[C@H]1CO)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.8543 |
| logD: | -0.4804 |
| logSw: | -2.5287 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.826 |
| InChI Key: | HPUZEUKYXSVIOA-SMDDNHRTSA-N |