2-[2-(4-chlorophenyl)ethyl]-N-cyclooctyl-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Chemical Structure Depiction of
2-[2-(4-chlorophenyl)ethyl]-N-cyclooctyl-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
2-[2-(4-chlorophenyl)ethyl]-N-cyclooctyl-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C794-1252 |
| Compound Name: | 2-[2-(4-chlorophenyl)ethyl]-N-cyclooctyl-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
| Molecular Weight: | 453.02 |
| Molecular Formula: | C27 H33 Cl N2 O2 |
| Smiles: | CC1(Cc2ccccc2C(N1CCc1ccc(cc1)[Cl])=O)C(NC1CCCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.6474 |
| logD: | 6.6474 |
| logSw: | -6.0772 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.381 |
| InChI Key: | KSHYCRBFRIPYTL-MHZLTWQESA-N |