2-cyclohexyl-N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-3-(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-cyclohexyl-N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-3-(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-cyclohexyl-N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-3-(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C066-0500 |
| Compound Name: | 2-cyclohexyl-N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-3-(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 531.74 |
| Molecular Formula: | C33 H45 N3 O3 |
| Smiles: | CC1CC(C)CN(CCCNC(C2C(c3ccc(cc3)OC)N(C3CCCCC3)C(c3ccccc23)=O)=O)C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4491 |
| logD: | 2.8442 |
| logSw: | -5.2729 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.521 |
| InChI Key: | HICHITIOVVNYNE-UHFFFAOYSA-N |