N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]butanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]butanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]butanamide
Compound characteristics
| Compound ID: | G423-0423 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[7-(4-ethoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]butanamide |
| Molecular Weight: | 475.5 |
| Molecular Formula: | C25 H25 N5 O5 |
| Smiles: | CCOc1ccc(cc1)N1C=Cn2c(CCCC(NCc3ccc4c(c3)OCO4)=O)nnc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.1907 |
| logD: | 1.1907 |
| logSw: | -2.1793 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.807 |
| InChI Key: | NHPNNURCMHOVIH-UHFFFAOYSA-N |