ethyl 3-{3-methyl-3-[(3-methylbutyl)carbamoyl]-1-oxo-3,4-dihydropyrazino[1,2-a]indol-2(1H)-yl}benzoate
Chemical Structure Depiction of
ethyl 3-{3-methyl-3-[(3-methylbutyl)carbamoyl]-1-oxo-3,4-dihydropyrazino[1,2-a]indol-2(1H)-yl}benzoate
ethyl 3-{3-methyl-3-[(3-methylbutyl)carbamoyl]-1-oxo-3,4-dihydropyrazino[1,2-a]indol-2(1H)-yl}benzoate
Compound characteristics
| Compound ID: | E234-2007 |
| Compound Name: | ethyl 3-{3-methyl-3-[(3-methylbutyl)carbamoyl]-1-oxo-3,4-dihydropyrazino[1,2-a]indol-2(1H)-yl}benzoate |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C27 H31 N3 O4 |
| Smiles: | CCOC(c1cccc(c1)N1C(c2cc3ccccc3n2CC1(C)C(NCCC(C)C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0989 |
| logD: | 5.0989 |
| logSw: | -5.4098 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.267 |
| InChI Key: | VKPTXEYJCGPJRA-MHZLTWQESA-N |