N-{3-[benzyl(ethyl)amino]propyl}-3-(4-ethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(ethyl)amino]propyl}-3-(4-ethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
N-{3-[benzyl(ethyl)amino]propyl}-3-(4-ethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | K999-0244 |
| Compound Name: | N-{3-[benzyl(ethyl)amino]propyl}-3-(4-ethoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 484.6 |
| Molecular Formula: | C29 H32 N4 O3 |
| Smiles: | CCN(CCCNC(C1c2ccccc2C(N(c2ccc(cc2)OCC)N=1)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.068 |
| logD: | 2.4777 |
| logSw: | -3.9439 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.112 |
| InChI Key: | CRPCLEUQYQFMDG-UHFFFAOYSA-N |