2-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-6-[(4-fluorophenyl)methyl]-5,7-dimethyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
Chemical Structure Depiction of
2-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-6-[(4-fluorophenyl)methyl]-5,7-dimethyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
2-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-6-[(4-fluorophenyl)methyl]-5,7-dimethyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
Compound characteristics
| Compound ID: | C891-1567 |
| Compound Name: | 2-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-6-[(4-fluorophenyl)methyl]-5,7-dimethyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one |
| Molecular Weight: | 487.58 |
| Molecular Formula: | C28 H30 F N5 O2 |
| Smiles: | Cc1c2C=NN(CC(N3CCN(CC3)Cc3ccccc3)=O)C(c2c(C)n1Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4975 |
| logD: | 2.4821 |
| logSw: | -2.3008 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.86 |
| InChI Key: | MRVUBTANMSLGCZ-UHFFFAOYSA-N |