{3-[(2S,4R)-4-hydroxy-1-methylpyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(3-methylphenyl)methanone
Chemical Structure Depiction of
{3-[(2S,4R)-4-hydroxy-1-methylpyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(3-methylphenyl)methanone
{3-[(2S,4R)-4-hydroxy-1-methylpyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(3-methylphenyl)methanone
Compound characteristics
| Compound ID: | S625-0009 |
| Compound Name: | {3-[(2S,4R)-4-hydroxy-1-methylpyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(3-methylphenyl)methanone |
| Molecular Weight: | 341.41 |
| Molecular Formula: | C18 H23 N5 O2 |
| Smiles: | Cc1cccc(c1)C(N1CCn2c(C1)nnc2[C@@H]1C[C@H](CN1C)O)=O |
| Stereo: | ABSOLUTE |
| logP: | -0.161 |
| logD: | -0.2074 |
| logSw: | -1.5966 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.922 |
| InChI Key: | VJFGCAGZVKFUIT-GJZGRUSLSA-N |