N-(2H-1,3-benzodioxol-5-yl)-2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)acetamide
Compound characteristics
| Compound ID: | D262-0934 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)acetamide |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C23 H21 N3 O4 |
| Smiles: | C1CCC2=C(C1)C(c1ccccc1)=NN(CC(Nc1ccc3c(c1)OCO3)=O)C2=O |
| Stereo: | ACHIRAL |
| logP: | 3.9701 |
| logD: | 3.9701 |
| logSw: | -4.1312 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.652 |
| InChI Key: | ASWBJAAXKRMCOY-UHFFFAOYSA-N |