3-(3,4-dimethoxyphenyl)-4-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-4-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydrophthalazine-1-carboxamide
3-(3,4-dimethoxyphenyl)-4-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | C066-0602 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-4-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 527.58 |
| Molecular Formula: | C29 H29 N5 O5 |
| Smiles: | COc1ccc(cc1OC)N1C(c2ccccc2C(C(NCC(N2CCN(CC2)c2ccccc2)=O)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5686 |
| logD: | 2.5685 |
| logSw: | -3.2925 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.375 |
| InChI Key: | MDACOYIMBUFFOB-UHFFFAOYSA-N |