{3-[(2S,4S)-1-benzyl-4-hydroxypyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(2,4-difluorophenyl)methanone
Chemical Structure Depiction of
{3-[(2S,4S)-1-benzyl-4-hydroxypyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(2,4-difluorophenyl)methanone
{3-[(2S,4S)-1-benzyl-4-hydroxypyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(2,4-difluorophenyl)methanone
Compound characteristics
| Compound ID: | S904-5302 |
| Compound Name: | {3-[(2S,4S)-1-benzyl-4-hydroxypyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(2,4-difluorophenyl)methanone |
| Molecular Weight: | 439.46 |
| Molecular Formula: | C23 H23 F2 N5 O2 |
| Smiles: | C1[C@@H](c2nnc3CN(CCn23)C(c2ccc(cc2F)F)=O)N(Cc2ccccc2)C[C@H]1O |
| Stereo: | ABSOLUTE |
| logP: | 1.7402 |
| logD: | 1.7352 |
| logSw: | -2.6864 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.935 |
| InChI Key: | ATCRFAFOBMXAGX-XLIONFOSSA-N |