4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]butan-1-one
Chemical Structure Depiction of
4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]butan-1-one
4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]butan-1-one
Compound characteristics
| Compound ID: | S565-1307 |
| Compound Name: | 4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[1-methyl-3-(4-methyl-4H-1,2,4-triazol-3-yl)-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl]butan-1-one |
| Molecular Weight: | 492.54 |
| Molecular Formula: | C24 H28 N8 O4 |
| Smiles: | Cn1cnnc1c1c2CN(CCc2n(C)n1)C(CCCc1nc(c2ccc(c(c2)OC)OC)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0603 |
| logD: | 1.0551 |
| logSw: | -2.1282 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 102.555 |
| InChI Key: | RZLASGSOGMIALK-UHFFFAOYSA-N |