N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | Y041-5545 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 337.33 |
| Molecular Formula: | C18 H15 N3 O4 |
| Smiles: | CN1C(c2ccccc2C(C(NCc2ccc3c(c2)OCO3)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6004 |
| logD: | 1.6004 |
| logSw: | -2.4628 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.946 |
| InChI Key: | HZWSOOKXMRNXLO-UHFFFAOYSA-N |