2-(2H-1,3-benzodioxol-5-yl)-N-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-N-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
2-(2H-1,3-benzodioxol-5-yl)-N-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y042-5600 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-N-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 366.37 |
| Molecular Formula: | C20 H18 N2 O5 |
| Smiles: | COCCNC(C1=CN(C(c2ccccc12)=O)c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5753 |
| logD: | 1.5753 |
| logSw: | -2.4524 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.739 |
| InChI Key: | XWQUZRLDSXMTFN-UHFFFAOYSA-N |