1-{3-[1-(methanesulfonyl)piperidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}-2-(1H-pyrazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-{3-[1-(methanesulfonyl)piperidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}-2-(1H-pyrazol-1-yl)ethan-1-one
1-{3-[1-(methanesulfonyl)piperidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}-2-(1H-pyrazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | S902-1155 |
| Compound Name: | 1-{3-[1-(methanesulfonyl)piperidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}-2-(1H-pyrazol-1-yl)ethan-1-one |
| Molecular Weight: | 393.47 |
| Molecular Formula: | C16 H23 N7 O3 S |
| Smiles: | CS(N1CCCCC1c1nnc2CN(CCn12)C(Cn1cccn1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -1.1425 |
| logD: | -1.1428 |
| logSw: | -1.0827 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 87.534 |
| InChI Key: | DAANYEQFPAPMMT-ZDUSSCGKSA-N |