1-[rel-(3R,4S)-3-[(dimethylamino)methyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]-2-(3-methylphenoxy)ethan-1-one
Chemical Structure Depiction of
1-[rel-(3R,4S)-3-[(dimethylamino)methyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]-2-(3-methylphenoxy)ethan-1-one
1-[rel-(3R,4S)-3-[(dimethylamino)methyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]-2-(3-methylphenoxy)ethan-1-one
Compound characteristics
| Compound ID: | SB53-0971 |
| Compound Name: | 1-[rel-(3R,4S)-3-[(dimethylamino)methyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]-2-(3-methylphenoxy)ethan-1-one |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C24 H28 N4 O3 |
| Smiles: | Cc1cccc(c1)OCC(N1C[C@H](CN(C)C)[C@H](C1)c1nnc(c2ccccc2)o1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9115 |
| logD: | 0.4439 |
| logSw: | -3.2793 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.223 |
| InChI Key: | QWLIVMMFOXHCPW-TZIWHRDSSA-N |