N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-7-methoxy-3-methyl-1-oxo-2-({4-[(propan-2-yl)oxy]phenyl}methyl)-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Chemical Structure Depiction of
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-7-methoxy-3-methyl-1-oxo-2-({4-[(propan-2-yl)oxy]phenyl}methyl)-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-7-methoxy-3-methyl-1-oxo-2-({4-[(propan-2-yl)oxy]phenyl}methyl)-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Compound characteristics
| Compound ID: | E522-0118 |
| Compound Name: | N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-7-methoxy-3-methyl-1-oxo-2-({4-[(propan-2-yl)oxy]phenyl}methyl)-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide |
| Molecular Weight: | 574.77 |
| Molecular Formula: | C34 H46 N4 O4 |
| Smiles: | CC1CC(C)CN(CCCNC(C2(C)Cn3c(cc4ccc(cc34)OC)C(N2Cc2ccc(cc2)OC(C)C)=O)=O)C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8257 |
| logD: | 3.2208 |
| logSw: | -5.6295 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.049 |
| InChI Key: | JSXFFODNDGTNRL-UHFFFAOYSA-N |