2-[(2H-1,3-benzodioxol-5-yl)methyl]-N-cycloheptyl-7-methyl-1-oxo-3-phenyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)methyl]-N-cycloheptyl-7-methyl-1-oxo-3-phenyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
2-[(2H-1,3-benzodioxol-5-yl)methyl]-N-cycloheptyl-7-methyl-1-oxo-3-phenyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Compound characteristics
| Compound ID: | E850-0494 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methyl]-N-cycloheptyl-7-methyl-1-oxo-3-phenyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide |
| Molecular Weight: | 549.67 |
| Molecular Formula: | C34 H35 N3 O4 |
| Smiles: | Cc1ccc2cc3C(N(Cc4ccc5c(c4)OCO5)C(Cn3c2c1)(C(NC1CCCCCC1)=O)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.4032 |
| logD: | 7.4032 |
| logSw: | -5.8742 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.321 |
| InChI Key: | IKYVYYZKJLZKFV-UUWRZZSWSA-N |