N-cycloheptyl-3-methyl-2-[3-(methylsulfanyl)phenyl]-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Chemical Structure Depiction of
N-cycloheptyl-3-methyl-2-[3-(methylsulfanyl)phenyl]-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
N-cycloheptyl-3-methyl-2-[3-(methylsulfanyl)phenyl]-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide
Compound characteristics
| Compound ID: | E234-1517 |
| Compound Name: | N-cycloheptyl-3-methyl-2-[3-(methylsulfanyl)phenyl]-1-oxo-1,2,3,4-tetrahydropyrazino[1,2-a]indole-3-carboxamide |
| Molecular Weight: | 461.63 |
| Molecular Formula: | C27 H31 N3 O2 S |
| Smiles: | CC1(Cn2c(cc3ccccc23)C(N1c1cccc(c1)SC)=O)C(NC1CCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7604 |
| logD: | 5.7604 |
| logSw: | -6.1745 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.457 |
| InChI Key: | LALXNNBVUNCCBU-MHZLTWQESA-N |