2-cyclohexyl-3-(4-methoxyphenyl)-N-[3-(morpholin-4-yl)propyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-cyclohexyl-3-(4-methoxyphenyl)-N-[3-(morpholin-4-yl)propyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-cyclohexyl-3-(4-methoxyphenyl)-N-[3-(morpholin-4-yl)propyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C066-0453 |
| Compound Name: | 2-cyclohexyl-3-(4-methoxyphenyl)-N-[3-(morpholin-4-yl)propyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 505.66 |
| Molecular Formula: | C30 H39 N3 O4 |
| Smiles: | COc1ccc(cc1)C1C(C(NCCCN2CCOCC2)=O)c2ccccc2C(N1C1CCCCC1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5026 |
| logD: | 3.0791 |
| logSw: | -3.6095 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.562 |
| InChI Key: | NUFCNSBBRBYDGC-UHFFFAOYSA-N |