2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-[(2-chloro-4-fluorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-[(2-chloro-4-fluorophenyl)methyl]acetamide
2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-[(2-chloro-4-fluorophenyl)methyl]acetamide
Compound characteristics
| Compound ID: | S333-0527 |
| Compound Name: | 2-{2-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-[(2-chloro-4-fluorophenyl)methyl]acetamide |
| Molecular Weight: | 454.84 |
| Molecular Formula: | C22 H16 Cl F N4 O4 |
| Smiles: | C(c1ccc(cc1[Cl])F)NC(Cn1cccc1c1nc(c2ccc3c(c2)OCO3)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.206 |
| logD: | 5.206 |
| logSw: | -5.8361 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.821 |
| InChI Key: | XDUUDZCETCMSLO-UHFFFAOYSA-N |