N-[3-(cyclohexylsulfanyl)propyl]-2-{5,7-dimethyl-6-[(4-methylphenyl)methyl]-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl}acetamide
Chemical Structure Depiction of
N-[3-(cyclohexylsulfanyl)propyl]-2-{5,7-dimethyl-6-[(4-methylphenyl)methyl]-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl}acetamide
N-[3-(cyclohexylsulfanyl)propyl]-2-{5,7-dimethyl-6-[(4-methylphenyl)methyl]-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl}acetamide
Compound characteristics
| Compound ID: | C891-1331 |
| Compound Name: | N-[3-(cyclohexylsulfanyl)propyl]-2-{5,7-dimethyl-6-[(4-methylphenyl)methyl]-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl}acetamide |
| Molecular Weight: | 480.67 |
| Molecular Formula: | C27 H36 N4 O2 S |
| Smiles: | Cc1ccc(Cn2c(C)c3C=NN(CC(NCCCSC4CCCCC4)=O)C(c3c2C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0619 |
| logD: | 4.0619 |
| logSw: | -4.0435 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.433 |
| InChI Key: | IOSRDLSUNFBRQU-UHFFFAOYSA-N |