{3-[(2S,4R)-4-hydroxy-1-methylpyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(3-methyl-1H-pyrazol-5-yl)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-methyl-1H-pyrazol-5-yl)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-methyl-1H-pyrazol-5-yl)methanone
Compound characteristics
Compound ID: | S625-0067 |
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-methyl-1H-pyrazol-5-yl)methanone |
Molecular Weight: | 331.38 |
Molecular Formula: | C15 H21 N7 O2 |
Smiles: | Cc1cc(C(N2CCn3c(C2)nnc3[C@@H]2C[C@H](CN2C)O)=O)[nH]n1 |
Stereo: | ABSOLUTE |
logP: | -1.3294 |
logD: | -1.3758 |
logSw: | -1.2308 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 83.49 |
InChI Key: | BWROITURSQCJMP-JQWIXIFHSA-N |