2-[2-(4-fluorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(3-methoxypropyl)acetamide
Chemical Structure Depiction of
2-[2-(4-fluorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(3-methoxypropyl)acetamide
2-[2-(4-fluorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(3-methoxypropyl)acetamide
Compound characteristics
Compound ID: | G598-2534 |
Compound Name: | 2-[2-(4-fluorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(3-methoxypropyl)acetamide |
Molecular Weight: | 438.46 |
Molecular Formula: | C22 H23 F N6 O3 |
Smiles: | CC1c2c(C(N(CC(NCCCOC)=O)N=1)=O)c(n1cccc1)n(c1ccc(cc1)F)n2 |
Stereo: | ACHIRAL |
logP: | 2.0842 |
logD: | 2.0842 |
logSw: | -2.7199 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 77.061 |
InChI Key: | ZKFJJEOFRUCFRY-UHFFFAOYSA-N |