1-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5(4H)-yl]-2-(3-methylphenoxy)ethan-1-one
Chemical Structure Depiction of
1-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5(4H)-yl]-2-(3-methylphenoxy)ethan-1-one
1-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5(4H)-yl]-2-(3-methylphenoxy)ethan-1-one
Compound characteristics
| Compound ID: | SB71-0466 |
| Compound Name: | 1-[2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5(4H)-yl]-2-(3-methylphenoxy)ethan-1-one |
| Molecular Weight: | 430.51 |
| Molecular Formula: | C25 H26 N4 O3 |
| Smiles: | Cc1cccc(c1)OCC(N1CCn2c(C1)cc(C(N1CCc3ccccc3C1)=O)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7517 |
| logD: | 2.7517 |
| logSw: | -2.8765 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.639 |
| InChI Key: | WCFJANILEHGPCW-UHFFFAOYSA-N |