6-benzyl-5,7-dimethyl-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
Chemical Structure Depiction of
6-benzyl-5,7-dimethyl-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
6-benzyl-5,7-dimethyl-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
Compound characteristics
| Compound ID: | C891-0014 |
| Compound Name: | 6-benzyl-5,7-dimethyl-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one |
| Molecular Weight: | 455.56 |
| Molecular Formula: | C27 H29 N5 O2 |
| Smiles: | Cc1c2C=NN(CC(N3CCN(CC3)c3ccccc3)=O)C(c2c(C)n1Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7874 |
| logD: | 2.7873 |
| logSw: | -2.9525 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.58 |
| InChI Key: | DGQLABCWXHOOQZ-UHFFFAOYSA-N |