1-{(2S)-2-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}-2-(3,4-diethoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-{(2S)-2-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}-2-(3,4-diethoxyphenyl)ethan-1-one
1-{(2S)-2-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}-2-(3,4-diethoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | S338-0039 |
| Compound Name: | 1-{(2S)-2-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}-2-(3,4-diethoxyphenyl)ethan-1-one |
| Molecular Weight: | 455.94 |
| Molecular Formula: | C24 H26 Cl N3 O4 |
| Smiles: | CCOc1ccc(CC(N2CCC[C@H]2c2nc(c3ccccc3[Cl])no2)=O)cc1OCC |
| Stereo: | ABSOLUTE |
| logP: | 4.3838 |
| logD: | 4.3838 |
| logSw: | -4.5383 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.245 |
| InChI Key: | WHPBXLYJNFQNBY-IBGZPJMESA-N |