3-(3,4-dimethoxyphenyl)-4-oxo-N-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydrophthalazine-1-carboxamide
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-4-oxo-N-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydrophthalazine-1-carboxamide
3-(3,4-dimethoxyphenyl)-4-oxo-N-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydrophthalazine-1-carboxamide
Compound characteristics
| Compound ID: | C066-0674 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-4-oxo-N-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-3,4-dihydrophthalazine-1-carboxamide |
| Molecular Weight: | 528.57 |
| Molecular Formula: | C28 H28 N6 O5 |
| Smiles: | COc1ccc(cc1OC)N1C(c2ccccc2C(C(NCC(N2CCN(CC2)c2ccccn2)=O)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2362 |
| logD: | 2.2273 |
| logSw: | -2.9465 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.886 |
| InChI Key: | FHULQGALWWUKJE-UHFFFAOYSA-N |