1-(4-{3-[(2S,4S)-4-hydroxy-1-(propan-2-yl)pyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}piperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(4-{3-[(2S,4S)-4-hydroxy-1-(propan-2-yl)pyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}piperidin-1-yl)ethan-1-one
1-(4-{3-[(2S,4S)-4-hydroxy-1-(propan-2-yl)pyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}piperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | S904-0084 |
| Compound Name: | 1-(4-{3-[(2S,4S)-4-hydroxy-1-(propan-2-yl)pyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}piperidin-1-yl)ethan-1-one |
| Molecular Weight: | 376.5 |
| Molecular Formula: | C19 H32 N6 O2 |
| Smiles: | CC(C)N1C[C@H](C[C@H]1c1nnc2CN(CCn12)C1CCN(CC1)C(C)=O)O |
| Stereo: | ABSOLUTE |
| logP: | -0.1196 |
| logD: | -0.2858 |
| logSw: | -0.2497 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.926 |
| InChI Key: | HBEQMQZMSJRJNY-SJORKVTESA-N |