N-{3-[benzyl(methyl)amino]propyl}-3-(4-ethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(methyl)amino]propyl}-3-(4-ethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
N-{3-[benzyl(methyl)amino]propyl}-3-(4-ethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | K999-0245 |
| Compound Name: | N-{3-[benzyl(methyl)amino]propyl}-3-(4-ethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 470.57 |
| Molecular Formula: | C28 H30 N4 O3 |
| Smiles: | CCOc1ccc(cc1)N1C(c2ccccc2C(C(NCCCN(C)Cc2ccccc2)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6112 |
| logD: | 2.1701 |
| logSw: | -3.6855 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.52 |
| InChI Key: | DJUJKXFNJSXAPG-UHFFFAOYSA-N |