N-cyclooctyl-3-methyl-1-oxo-2-(4-phenylbutan-2-yl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Chemical Structure Depiction of
N-cyclooctyl-3-methyl-1-oxo-2-(4-phenylbutan-2-yl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
N-cyclooctyl-3-methyl-1-oxo-2-(4-phenylbutan-2-yl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C794-1263 |
| Compound Name: | N-cyclooctyl-3-methyl-1-oxo-2-(4-phenylbutan-2-yl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
| Molecular Weight: | 446.63 |
| Molecular Formula: | C29 H38 N2 O2 |
| Smiles: | CC(CCc1ccccc1)N1C(c2ccccc2CC1(C)C(NC1CCCCCCC1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.5426 |
| logD: | 6.5426 |
| logSw: | -5.6275 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.708 |
| InChI Key: | WRLONJFKHZNMEH-UHFFFAOYSA-N |