N-[(4-oxo-3,4-dihydrophthalazin-1-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[(4-oxo-3,4-dihydrophthalazin-1-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
N-[(4-oxo-3,4-dihydrophthalazin-1-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | G856-5782 |
| Compound Name: | N-[(4-oxo-3,4-dihydrophthalazin-1-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 323.31 |
| Molecular Formula: | C17 H13 N3 O4 |
| Smiles: | C(C1c2ccccc2C(NN=1)=O)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6188 |
| logD: | 1.6187 |
| logSw: | -2.5127 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.062 |
| InChI Key: | WSAOIUMFUNELIU-UHFFFAOYSA-N |