N-cyclopentyl-7-methoxy-3-methyl-2-{2-[4-(methylsulfanyl)phenyl]ethyl}-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-7-methoxy-3-methyl-2-{2-[4-(methylsulfanyl)phenyl]ethyl}-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
N-cyclopentyl-7-methoxy-3-methyl-2-{2-[4-(methylsulfanyl)phenyl]ethyl}-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Compound characteristics
| Compound ID: | E234-1216 |
| Compound Name: | N-cyclopentyl-7-methoxy-3-methyl-2-{2-[4-(methylsulfanyl)phenyl]ethyl}-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide |
| Molecular Weight: | 491.65 |
| Molecular Formula: | C28 H33 N3 O3 S |
| Smiles: | CC1(Cn2c(cc3ccc(cc23)OC)C(N1CCc1ccc(cc1)SC)=O)C(NC1CCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7393 |
| logD: | 5.7393 |
| logSw: | -5.648 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.625 |
| InChI Key: | QPJLOYFPDKPUJR-NDEPHWFRSA-N |