2-(benzyloxy)-1-[(2S,4S)-4-hydroxy-2-(7-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)pyrrolidin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(benzyloxy)-1-[(2S,4S)-4-hydroxy-2-(7-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)pyrrolidin-1-yl]ethan-1-one
2-(benzyloxy)-1-[(2S,4S)-4-hydroxy-2-(7-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)pyrrolidin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S904-1050 |
| Compound Name: | 2-(benzyloxy)-1-[(2S,4S)-4-hydroxy-2-(7-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)pyrrolidin-1-yl]ethan-1-one |
| Molecular Weight: | 371.44 |
| Molecular Formula: | C19 H25 N5 O3 |
| Smiles: | CN1CCn2c(C1)nnc2[C@@H]1C[C@@H](CN1C(COCc1ccccc1)=O)O |
| Stereo: | ABSOLUTE |
| logP: | -0.1738 |
| logD: | -0.1816 |
| logSw: | -1.2084 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.612 |
| InChI Key: | VXANVUDSOMEFJS-CVEARBPZSA-N |