(5S,8aR)-5-benzyl-2-[(2-chloro-6-fluorophenyl)methyl]-7-methyltetrahydroimidazo[1,5-a]pyrazine-3,6(2H,5H)-dione
Chemical Structure Depiction of
(5S,8aR)-5-benzyl-2-[(2-chloro-6-fluorophenyl)methyl]-7-methyltetrahydroimidazo[1,5-a]pyrazine-3,6(2H,5H)-dione
(5S,8aR)-5-benzyl-2-[(2-chloro-6-fluorophenyl)methyl]-7-methyltetrahydroimidazo[1,5-a]pyrazine-3,6(2H,5H)-dione
Compound characteristics
| Compound ID: | SB42-0553 |
| Compound Name: | (5S,8aR)-5-benzyl-2-[(2-chloro-6-fluorophenyl)methyl]-7-methyltetrahydroimidazo[1,5-a]pyrazine-3,6(2H,5H)-dione |
| Molecular Weight: | 401.87 |
| Molecular Formula: | C21 H21 Cl F N3 O2 |
| Smiles: | CN1C[C@@H]2CN(Cc3c(cccc3[Cl])F)C(N2[C@@H](Cc2ccccc2)C1=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.3129 |
| logD: | 3.3129 |
| logSw: | -3.5576 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.082 |
| InChI Key: | QPYOBLJCBYPIOI-KXBFYZLASA-N |