6-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-5,7-dimethyl-2-phenyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
Chemical Structure Depiction of
6-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-5,7-dimethyl-2-phenyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
6-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-5,7-dimethyl-2-phenyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
Compound characteristics
| Compound ID: | C890-0020 |
| Compound Name: | 6-{2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-5,7-dimethyl-2-phenyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one |
| Molecular Weight: | 469.59 |
| Molecular Formula: | C28 H31 N5 O2 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(Cn1c(C)c2C=NN(C(c2c1C)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8459 |
| logD: | 3.8457 |
| logSw: | -4.1213 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.86 |
| InChI Key: | XROREITZSPKMTO-UHFFFAOYSA-N |