2-(4-{4-[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazin-1-yl}-4-oxobutyl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(4-{4-[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazin-1-yl}-4-oxobutyl)-1H-isoindole-1,3(2H)-dione
2-(4-{4-[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazin-1-yl}-4-oxobutyl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | F980-0420 |
| Compound Name: | 2-(4-{4-[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazin-1-yl}-4-oxobutyl)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 499.57 |
| Molecular Formula: | C28 H29 N5 O4 |
| Smiles: | Cc1ccc(cc1C)N1C(C=CC(=N1)N1CCN(CC1)C(CCCN1C(c2ccccc2C1=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7287 |
| logD: | 2.7287 |
| logSw: | -3.1653 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 76.136 |
| InChI Key: | DMIVHLNYNIGIDH-UHFFFAOYSA-N |