{3-[(2S,4R)-1-benzyl-4-hydroxypyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(4-methyl-1,3-oxazol-5-yl)methanone
Chemical Structure Depiction of
{3-[(2S,4R)-1-benzyl-4-hydroxypyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(4-methyl-1,3-oxazol-5-yl)methanone
{3-[(2S,4R)-1-benzyl-4-hydroxypyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(4-methyl-1,3-oxazol-5-yl)methanone
Compound characteristics
| Compound ID: | S625-0313 |
| Compound Name: | {3-[(2S,4R)-1-benzyl-4-hydroxypyrrolidin-2-yl]-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl}(4-methyl-1,3-oxazol-5-yl)methanone |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C21 H24 N6 O3 |
| Smiles: | Cc1c(C(N2CCn3c(C2)nnc3[C@@H]2C[C@H](CN2Cc2ccccc2)O)=O)ocn1 |
| Stereo: | ABSOLUTE |
| logP: | 0.1046 |
| logD: | 0.0996 |
| logSw: | -1.3608 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.849 |
| InChI Key: | UNVMGFNFTXJMCZ-IRXDYDNUSA-N |