2-(2-chloro-6-fluorophenyl)-1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(2-chloro-6-fluorophenyl)-1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethan-1-one
2-(2-chloro-6-fluorophenyl)-1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S826-3103 |
| Compound Name: | 2-(2-chloro-6-fluorophenyl)-1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethan-1-one |
| Molecular Weight: | 353.78 |
| Molecular Formula: | C16 H17 Cl F N3 O3 |
| Smiles: | Cc1nc([C@@H]2CN(C[C@H]2CO)C(Cc2c(cccc2[Cl])F)=O)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.9344 |
| logD: | 1.9344 |
| logSw: | -2.5616 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.997 |
| InChI Key: | FIZYQKGIGDVKTK-CMPLNLGQSA-N |