2-(3,4-diethoxyphenyl)-1-{(2S)-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3,4-diethoxyphenyl)-1-{(2S)-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one
2-(3,4-diethoxyphenyl)-1-{(2S)-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S338-0408 |
| Compound Name: | 2-(3,4-diethoxyphenyl)-1-{(2S)-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C25 H29 N3 O5 |
| Smiles: | CCOc1ccc(CC(N2CCC[C@H]2c2nc(c3ccc(cc3)OC)no2)=O)cc1OCC |
| Stereo: | ABSOLUTE |
| logP: | 4.2001 |
| logD: | 4.2001 |
| logSw: | -4.2869 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.789 |
| InChI Key: | UHQBXOFXTCAMTP-FQEVSTJZSA-N |