1-{1-methyl-3-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl}-2-(2-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-{1-methyl-3-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl}-2-(2-methylphenyl)ethan-1-one
1-{1-methyl-3-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl}-2-(2-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | SA50-0929 |
| Compound Name: | 1-{1-methyl-3-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl}-2-(2-methylphenyl)ethan-1-one |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C22 H25 N5 O3 |
| Smiles: | Cc1ccccc1CC(N1Cc2c(c3nc(C4CCOCC4)no3)nn(C)c2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.901 |
| logD: | 2.901 |
| logSw: | -2.8697 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 70.845 |
| InChI Key: | JPWZXNBUGKKTIE-UHFFFAOYSA-N |