N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{2-[(4-fluorophenyl)-N-methylcarbamamido]ethyl}-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{2-[(4-fluorophenyl)-N-methylcarbamamido]ethyl}-1,2,4-oxadiazole-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{2-[(4-fluorophenyl)-N-methylcarbamamido]ethyl}-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | L080-0419 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{2-[(4-fluorophenyl)-N-methylcarbamamido]ethyl}-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 441.42 |
| Molecular Formula: | C21 H20 F N5 O5 |
| Smiles: | CN(CCc1nc(C(NCc2ccc3c(c2)OCO3)=O)on1)C(Nc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4141 |
| logD: | 2.4141 |
| logSw: | -3.0844 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.656 |
| InChI Key: | LCPWZQYLVRDTSI-UHFFFAOYSA-N |