ethyl 4-(2-{6-[(2-fluorophenyl)methyl]-5,7-dimethyl-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{6-[(2-fluorophenyl)methyl]-5,7-dimethyl-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl}acetamido)benzoate
ethyl 4-(2-{6-[(2-fluorophenyl)methyl]-5,7-dimethyl-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | C891-1886 |
| Compound Name: | ethyl 4-(2-{6-[(2-fluorophenyl)methyl]-5,7-dimethyl-1-oxo-1,6-dihydro-2H-pyrrolo[3,4-d]pyridazin-2-yl}acetamido)benzoate |
| Molecular Weight: | 476.51 |
| Molecular Formula: | C26 H25 F N4 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(CN1C(c2c(C=N1)c(C)n(Cc1ccccc1F)c2C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0819 |
| logD: | 4.0818 |
| logSw: | -4.2135 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.831 |
| InChI Key: | IKXQPBNGWLINFC-UHFFFAOYSA-N |