N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamide
Compound characteristics
| Compound ID: | C890-0988 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamide |
| Molecular Weight: | 497.64 |
| Molecular Formula: | C30 H35 N5 O2 |
| Smiles: | Cc1c2C=NN(C(c2c(C)n1CCCC(NCCCN1CCc2ccccc2C1)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5483 |
| logD: | 1.3443 |
| logSw: | -2.7723 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.444 |
| InChI Key: | ABLWCFDMNCPKBK-UHFFFAOYSA-N |