N-[3-(cyclohexylsulfanyl)propyl]-2-{6-[(2-fluorophenyl)methyl]-5,7-dimethyl-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl}acetamide
Chemical Structure Depiction of
N-[3-(cyclohexylsulfanyl)propyl]-2-{6-[(2-fluorophenyl)methyl]-5,7-dimethyl-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl}acetamide
N-[3-(cyclohexylsulfanyl)propyl]-2-{6-[(2-fluorophenyl)methyl]-5,7-dimethyl-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl}acetamide
Compound characteristics
| Compound ID: | C891-1994 |
| Compound Name: | N-[3-(cyclohexylsulfanyl)propyl]-2-{6-[(2-fluorophenyl)methyl]-5,7-dimethyl-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl}acetamide |
| Molecular Weight: | 484.64 |
| Molecular Formula: | C26 H33 F N4 O2 S |
| Smiles: | Cc1c2C=NN(CC(NCCCSC3CCCCC3)=O)C(c2c(C)n1Cc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9165 |
| logD: | 3.9165 |
| logSw: | -3.9977 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.433 |
| InChI Key: | NYJJZICJLLEQKB-UHFFFAOYSA-N |