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-[(oxolan-2-yl)methyl]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-[(oxolan-2-yl)methyl]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-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | G598-0608 |
| 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-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 466.93 |
| Molecular Formula: | C23 H23 Cl N6 O3 |
| Smiles: | CC1c2c(C(N(CC(NCC3CCCO3)=O)N=1)=O)c(n1cccc1)n(c1ccc(cc1)[Cl])n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5719 |
| logD: | 2.5719 |
| logSw: | -3.5003 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.26 |
| InChI Key: | HEIZCWLZVUJPMM-GOSISDBHSA-N |