1-[rel-(3R,4S)-3-[(dimethylamino)methyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]-2-(3-methylphenyl)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-methylphenyl)ethan-1-one
1-[rel-(3R,4S)-3-[(dimethylamino)methyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]-2-(3-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | SB53-0947 |
| Compound Name: | 1-[rel-(3R,4S)-3-[(dimethylamino)methyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]-2-(3-methylphenyl)ethan-1-one |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C24 H28 N4 O2 |
| Smiles: | Cc1cccc(CC(N2C[C@H](CN(C)C)[C@H](C2)c2nnc(c3ccccc3)o2)=O)c1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.6105 |
| logD: | 1.1428 |
| logSw: | -3.8495 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.724 |
| InChI Key: | CGGOKHYCLMOESX-NHCUHLMSSA-N |