(7S,9aS)-7-methyl-2-(2-methylpropyl)-8-{5-methyl-4-[(pyrrolidin-1-yl)methyl]-1,2-oxazole-3-carbonyl}hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
Chemical Structure Depiction of
(7S,9aS)-7-methyl-2-(2-methylpropyl)-8-{5-methyl-4-[(pyrrolidin-1-yl)methyl]-1,2-oxazole-3-carbonyl}hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
(7S,9aS)-7-methyl-2-(2-methylpropyl)-8-{5-methyl-4-[(pyrrolidin-1-yl)methyl]-1,2-oxazole-3-carbonyl}hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione
Compound characteristics
| Compound ID: | S975-0683 |
| Compound Name: | (7S,9aS)-7-methyl-2-(2-methylpropyl)-8-{5-methyl-4-[(pyrrolidin-1-yl)methyl]-1,2-oxazole-3-carbonyl}hexahydro-2H-pyrazino[1,2-a]pyrazine-1,6-dione |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C22 H33 N5 O4 |
| Smiles: | CC(C)CN1CCN2C([C@H](C)N(C[C@H]2C1=O)C(c1c(CN2CCCC2)c(C)on1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.8242 |
| logD: | -5.0801 |
| logSw: | -0.4603 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.192 |
| InChI Key: | LEKVSUNDIDYFQG-QAPCUYQASA-N |