N-(2-chloro-4-fluorophenyl)-2-cyclohexyl-3-(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-fluorophenyl)-2-cyclohexyl-3-(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-(2-chloro-4-fluorophenyl)-2-cyclohexyl-3-(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C066-0435 |
| Compound Name: | N-(2-chloro-4-fluorophenyl)-2-cyclohexyl-3-(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 507 |
| Molecular Formula: | C29 H28 Cl F N2 O3 |
| Smiles: | COc1ccc(cc1)C1C(C(Nc2ccc(cc2[Cl])F)=O)c2ccccc2C(N1C1CCCCC1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.3712 |
| logD: | 6.0603 |
| logSw: | -6.1424 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.81 |
| InChI Key: | RNQHRYZAMZOAJG-UHFFFAOYSA-N |