N-cyclooctyl-2-[(4-fluorophenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazole-3-carboxamide
Chemical Structure Depiction of
N-cyclooctyl-2-[(4-fluorophenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazole-3-carboxamide
N-cyclooctyl-2-[(4-fluorophenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazole-3-carboxamide
Compound characteristics
| Compound ID: | E525-0967 |
| Compound Name: | N-cyclooctyl-2-[(4-fluorophenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazole-3-carboxamide |
| Molecular Weight: | 462.57 |
| Molecular Formula: | C27 H31 F N4 O2 |
| Smiles: | CC1(Cn2c3ccccc3nc2C(N1Cc1ccc(cc1)F)=O)C(NC1CCCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7727 |
| logD: | 5.7727 |
| logSw: | -5.4053 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.633 |
| InChI Key: | DEHMXZHFBZINHJ-MHZLTWQESA-N |