2-(2-methoxyethyl)-N-[3-(methylsulfanyl)phenyl]-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(2-methoxyethyl)-N-[3-(methylsulfanyl)phenyl]-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-(2-methoxyethyl)-N-[3-(methylsulfanyl)phenyl]-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-0527 |
| Compound Name: | 2-(2-methoxyethyl)-N-[3-(methylsulfanyl)phenyl]-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 452.59 |
| Molecular Formula: | C24 H24 N2 O3 S2 |
| Smiles: | COCCN1C(C(C(Nc2cccc(c2)SC)=O)c2ccccc2C1=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9597 |
| logD: | 3.9596 |
| logSw: | -4.0086 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.353 |
| InChI Key: | UNYDPFCXWFRWOO-UHFFFAOYSA-N |