5-[2-(azepan-1-yl)-2-oxoethyl]-2-(3-fluorophenyl)-7-methyl-3-(1H-pyrrol-1-yl)-2,5-dihydro-4H-pyrazolo[3,4-d]pyridazin-4-one
Chemical Structure Depiction of
5-[2-(azepan-1-yl)-2-oxoethyl]-2-(3-fluorophenyl)-7-methyl-3-(1H-pyrrol-1-yl)-2,5-dihydro-4H-pyrazolo[3,4-d]pyridazin-4-one
5-[2-(azepan-1-yl)-2-oxoethyl]-2-(3-fluorophenyl)-7-methyl-3-(1H-pyrrol-1-yl)-2,5-dihydro-4H-pyrazolo[3,4-d]pyridazin-4-one
Compound characteristics
| Compound ID: | G598-2776 |
| Compound Name: | 5-[2-(azepan-1-yl)-2-oxoethyl]-2-(3-fluorophenyl)-7-methyl-3-(1H-pyrrol-1-yl)-2,5-dihydro-4H-pyrazolo[3,4-d]pyridazin-4-one |
| Molecular Weight: | 448.5 |
| Molecular Formula: | C24 H25 F N6 O2 |
| Smiles: | CC1c2c(C(N(CC(N3CCCCCC3)=O)N=1)=O)c(n1cccc1)n(c1cccc(c1)F)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.4599 |
| logD: | 3.4599 |
| logSw: | -3.7922 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.857 |
| InChI Key: | OZQMJDZVPHCZPS-UHFFFAOYSA-N |