N-benzyl-2-[(4-ethoxy-3-methoxyphenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Chemical Structure Depiction of
N-benzyl-2-[(4-ethoxy-3-methoxyphenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
N-benzyl-2-[(4-ethoxy-3-methoxyphenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Compound characteristics
Compound ID: | E234-1885 |
Compound Name: | N-benzyl-2-[(4-ethoxy-3-methoxyphenyl)methyl]-3-methyl-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide |
Molecular Weight: | 497.59 |
Molecular Formula: | C30 H31 N3 O4 |
Smiles: | CCOc1ccc(CN2C(c3cc4ccccc4n3CC2(C)C(NCc2ccccc2)=O)=O)cc1OC |
Stereo: | RACEMIC MIXTURE |
logP: | 4.8613 |
logD: | 4.8613 |
logSw: | -5.0611 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.852 |
InChI Key: | XNJVIQLCNGMONR-PMERELPUSA-N |