ethyl 1-[2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperidine-3-carboxylate
ethyl 1-[2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperidine-3-carboxylate
Compound characteristics
| Compound ID: | E456-0758 |
| Compound Name: | ethyl 1-[2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperidine-3-carboxylate |
| Molecular Weight: | 468.61 |
| Molecular Formula: | C26 H32 N2 O4 S |
| Smiles: | CCOC(C1CCCN(C1)C(C1C(c2cccs2)N(CC(C)C)C(c2ccccc12)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0624 |
| logD: | 4.0624 |
| logSw: | -4.1057 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.277 |
| InChI Key: | CDGGDDLJRHABSP-UHFFFAOYSA-N |