1-{[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]acetyl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-{[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]acetyl}piperidine-4-carboxamide
1-{[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]acetyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G598-0540 |
| Compound Name: | 1-{[2-(4-chlorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]acetyl}piperidine-4-carboxamide |
| Molecular Weight: | 493.95 |
| Molecular Formula: | C24 H24 Cl N7 O3 |
| Smiles: | CC1c2c(C(N(CC(N3CCC(CC3)C(N)=O)=O)N=1)=O)c(n1cccc1)n(c1ccc(cc1)[Cl])n2 |
| Stereo: | ACHIRAL |
| logP: | 1.8679 |
| logD: | 1.8679 |
| logSw: | -2.9281 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.585 |
| InChI Key: | JTADRONKGWNRHX-UHFFFAOYSA-N |