{3-[(2S,4R)-4-hydroxy-1-methylpyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(4-methoxy-2-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}(4-methoxy-2-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}(4-methoxy-2-methylphenyl)methanone
Compound characteristics
| Compound ID: | S625-1646 |
| 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}(4-methoxy-2-methylphenyl)methanone |
| Molecular Weight: | 371.44 |
| Molecular Formula: | C19 H25 N5 O3 |
| Smiles: | Cc1cc(ccc1C(N1CCn2c(C1)nnc2[C@@H]1C[C@H](CN1C)O)=O)OC |
| Stereo: | ABSOLUTE |
| logP: | 0.1235 |
| logD: | 0.0771 |
| logSw: | -2.2043 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.465 |
| InChI Key: | COGOMQKMIUVUSD-BBRMVZONSA-N |