{3-[(2S,4R)-4-hydroxy-1-methylpyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}[5-(3-methylphenyl)-1,3-oxazol-4-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}[5-(3-methylphenyl)-1,3-oxazol-4-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}[5-(3-methylphenyl)-1,3-oxazol-4-yl]methanone
Compound characteristics
| Compound ID: | S625-0014 |
| 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}[5-(3-methylphenyl)-1,3-oxazol-4-yl]methanone |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C21 H24 N6 O3 |
| Smiles: | Cc1cccc(c1)c1c(C(N2CCn3c(C2)nnc3[C@@H]2C[C@H](CN2C)O)=O)nco1 |
| Stereo: | ABSOLUTE |
| logP: | 0.2804 |
| logD: | 0.234 |
| logSw: | -1.6421 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.758 |
| InChI Key: | RHZZSKSHIYHSHS-HOTGVXAUSA-N |