2-[(5-bromo-2-methoxyphenyl)methyl]-N-cyclooctyl-7-methyl-1-oxo-3-phenyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Chemical Structure Depiction of
2-[(5-bromo-2-methoxyphenyl)methyl]-N-cyclooctyl-7-methyl-1-oxo-3-phenyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
2-[(5-bromo-2-methoxyphenyl)methyl]-N-cyclooctyl-7-methyl-1-oxo-3-phenyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Compound characteristics
| Compound ID: | E850-0622 |
| Compound Name: | 2-[(5-bromo-2-methoxyphenyl)methyl]-N-cyclooctyl-7-methyl-1-oxo-3-phenyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide |
| Molecular Weight: | 628.61 |
| Molecular Formula: | C35 H38 Br N3 O3 |
| Smiles: | Cc1ccc2cc3C(N(Cc4cc(ccc4OC)[Br])C(Cn3c2c1)(C(NC1CCCCCCC1)=O)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.652 |
| logD: | 8.652 |
| logSw: | -5.9173 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.836 |
| InChI Key: | NJYYZUHFVQJWMB-PGUFJCEWSA-N |