N-{2-[butyl(ethyl)amino]ethyl}-6,7-dimethoxy-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-{2-[butyl(ethyl)amino]ethyl}-6,7-dimethoxy-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-{2-[butyl(ethyl)amino]ethyl}-6,7-dimethoxy-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C138-0541 |
| Compound Name: | N-{2-[butyl(ethyl)amino]ethyl}-6,7-dimethoxy-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 473.63 |
| Molecular Formula: | C25 H35 N3 O4 S |
| Smiles: | CCCCN(CC)CCNC(C1C(c2cccs2)N(C)C(c2cc(c(cc12)OC)OC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7034 |
| logD: | 0.731 |
| logSw: | -3.2094 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.159 |
| InChI Key: | QBKDHDIUCUFQQE-UHFFFAOYSA-N |