ethyl 1-[2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperidine-4-carboxylate
ethyl 1-[2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | E456-1049 |
| Compound Name: | ethyl 1-[2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperidine-4-carboxylate |
| Molecular Weight: | 480.63 |
| Molecular Formula: | C27 H32 N2 O4 S |
| Smiles: | CCOC(C1CCN(CC1)C(C1C(c2cccs2)N(C2CCCC2)C(c2ccccc12)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9333 |
| logD: | 3.9333 |
| logSw: | -3.9048 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.659 |
| InChI Key: | SXCDQCXTADHHOY-UHFFFAOYSA-N |