ethyl 4-[3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperazine-1-carboxylate
ethyl 4-[3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | C096-1187 |
| Compound Name: | ethyl 4-[3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]piperazine-1-carboxylate |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C25 H29 N3 O5 |
| Smiles: | CCOC(N1CCN(CC1)C(C1C(c2ccc(cc2)OC)N(C)C(c2ccccc12)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5072 |
| logD: | 2.5072 |
| logSw: | -2.7024 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.661 |
| InChI Key: | LLJNCOMAIKXAAB-UHFFFAOYSA-N |