N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxo-1-{3-[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]phenyl}pyrrolidine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxo-1-{3-[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]phenyl}pyrrolidine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxo-1-{3-[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]phenyl}pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | F549-1207 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxo-1-{3-[5-(thiophen-2-yl)-1,2,4-oxadiazol-3-yl]phenyl}pyrrolidine-3-carboxamide |
| Molecular Weight: | 488.52 |
| Molecular Formula: | C25 H20 N4 O5 S |
| Smiles: | C1C(CN(C1=O)c1cccc(c1)c1nc(c2cccs2)on1)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7518 |
| logD: | 3.7518 |
| logSw: | -4.0439 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.941 |
| InChI Key: | HNAYKLHRKYPPAE-QGZVFWFLSA-N |