1-{(2S)-2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}-2-(2-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-{(2S)-2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}-2-(2-methoxyphenyl)ethan-1-one
1-{(2S)-2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}-2-(2-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | S338-0997 |
| Compound Name: | 1-{(2S)-2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}-2-(2-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 423.47 |
| Molecular Formula: | C23 H25 N3 O5 |
| Smiles: | COc1ccccc1CC(N1CCC[C@H]1c1nc(c2ccc(c(c2)OC)OC)no1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.8465 |
| logD: | 3.8465 |
| logSw: | -4.0194 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.716 |
| InChI Key: | WQTUOJGAIQQXNK-KRWDZBQOSA-N |