2-[(2-bromophenyl)methyl]-7-methoxy-3-methyl-1-oxo-N-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Chemical Structure Depiction of
2-[(2-bromophenyl)methyl]-7-methoxy-3-methyl-1-oxo-N-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
2-[(2-bromophenyl)methyl]-7-methoxy-3-methyl-1-oxo-N-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Compound characteristics
| Compound ID: | E522-0080 |
| Compound Name: | 2-[(2-bromophenyl)methyl]-7-methoxy-3-methyl-1-oxo-N-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide |
| Molecular Weight: | 526.43 |
| Molecular Formula: | C26 H28 Br N3 O4 |
| Smiles: | CC1(Cn2c(cc3ccc(cc23)OC)C(N1Cc1ccccc1[Br])=O)C(NCC1CCCO1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1705 |
| logD: | 4.1705 |
| logSw: | -4.3474 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.21 |
| InChI Key: | DOFXLQDTMYUFLQ-UHFFFAOYSA-N |