(2-fluorophenyl)[3-{(2S,4R)-4-hydroxy-1-[(pyridin-3-yl)methyl]pyrrolidin-2-yl}-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]methanone
Chemical Structure Depiction of
(2-fluorophenyl)[3-{(2S,4R)-4-hydroxy-1-[(pyridin-3-yl)methyl]pyrrolidin-2-yl}-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]methanone
(2-fluorophenyl)[3-{(2S,4R)-4-hydroxy-1-[(pyridin-3-yl)methyl]pyrrolidin-2-yl}-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]methanone
Compound characteristics
Compound ID: | S625-0364 |
Compound Name: | (2-fluorophenyl)[3-{(2S,4R)-4-hydroxy-1-[(pyridin-3-yl)methyl]pyrrolidin-2-yl}-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]methanone |
Molecular Weight: | 422.46 |
Molecular Formula: | C22 H23 F N6 O2 |
Smiles: | C1[C@@H](c2nnc3CN(CCn23)C(c2ccccc2F)=O)N(Cc2cccnc2)C[C@@H]1O |
Stereo: | ABSOLUTE |
logP: | 0.1058 |
logD: | 0.1047 |
logSw: | -1.584 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.453 |
InChI Key: | OPXRFXCHKUUGLY-LPHOPBHVSA-N |