3-methyl-1-(4-{7-[3-(4-methyl-1H-pyrazol-1-yl)propanoyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}piperidin-1-yl)butan-1-one
Chemical Structure Depiction of
3-methyl-1-(4-{7-[3-(4-methyl-1H-pyrazol-1-yl)propanoyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}piperidin-1-yl)butan-1-one
3-methyl-1-(4-{7-[3-(4-methyl-1H-pyrazol-1-yl)propanoyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}piperidin-1-yl)butan-1-one
Compound characteristics
| Compound ID: | S903-1439 |
| Compound Name: | 3-methyl-1-(4-{7-[3-(4-methyl-1H-pyrazol-1-yl)propanoyl]-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl}piperidin-1-yl)butan-1-one |
| Molecular Weight: | 427.55 |
| Molecular Formula: | C22 H33 N7 O2 |
| Smiles: | CC(C)CC(N1CCC(CC1)c1nnc2CN(CCn12)C(CCn1cc(C)cn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6256 |
| logD: | 0.6256 |
| logSw: | -0.6516 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.942 |
| InChI Key: | WOCAPPDOGKQIEQ-UHFFFAOYSA-N |