1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]-4-phenylbutan-1-one
Chemical Structure Depiction of
1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]-4-phenylbutan-1-one
1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]-4-phenylbutan-1-one
Compound characteristics
| Compound ID: | S826-3102 |
| Compound Name: | 1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]-4-phenylbutan-1-one |
| Molecular Weight: | 329.4 |
| Molecular Formula: | C18 H23 N3 O3 |
| Smiles: | Cc1nc([C@@H]2CN(C[C@H]2CO)C(CCCc2ccccc2)=O)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1624 |
| logD: | 2.1624 |
| logSw: | -2.631 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.997 |
| InChI Key: | NRTWMYQERYUNAT-JKSUJKDBSA-N |