ethyl 4-[2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperazine-1-carboxylate
ethyl 4-[2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | E456-0745 |
| Compound Name: | ethyl 4-[2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperazine-1-carboxylate |
| Molecular Weight: | 469.6 |
| Molecular Formula: | C25 H31 N3 O4 S |
| Smiles: | CCOC(N1CCN(CC1)C(C1C(c2cccs2)N(CC(C)C)C(c2ccccc12)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.671 |
| logD: | 3.671 |
| logSw: | -3.844 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.369 |
| InChI Key: | WYUGJAHEWYMJCC-UHFFFAOYSA-N |