2-(4-chlorophenoxy)-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-(4-chlorophenoxy)-1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethan-1-one
2-(4-chlorophenoxy)-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: | S826-3482 |
| Compound Name: | 2-(4-chlorophenoxy)-1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]ethan-1-one |
| Molecular Weight: | 351.79 |
| Molecular Formula: | C16 H18 Cl N3 O4 |
| Smiles: | Cc1nc([C@@H]2CN(C[C@H]2CO)C(COc2ccc(cc2)[Cl])=O)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3693 |
| logD: | 1.3693 |
| logSw: | -2.4712 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.497 |
| InChI Key: | UGMCWQTVTZUIKT-SMDDNHRTSA-N |