2-[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-[2-(piperidin-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-[2-(piperidin-1-yl)ethyl]acetamide
2-[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-[2-(piperidin-1-yl)ethyl]acetamide
Compound characteristics
Compound ID: | G598-0611 |
Compound Name: | 2-[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-[2-(piperidin-1-yl)ethyl]acetamide |
Molecular Weight: | 494 |
Molecular Formula: | C25 H28 Cl N7 O2 |
Smiles: | CC1c2c(C(N(CC(NCCN3CCCCC3)=O)N=1)=O)c(n1cccc1)n(c1ccc(cc1)[Cl])n2 |
Stereo: | ACHIRAL |
logP: | 3.1368 |
logD: | 1.6264 |
logSw: | -3.8345 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.429 |
InChI Key: | IAHNOEUZQAQZDG-UHFFFAOYSA-N |