2-[2-(4-chlorophenyl)ethyl]-3-methyl-N-(4-methylcyclohexyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Chemical Structure Depiction of
2-[2-(4-chlorophenyl)ethyl]-3-methyl-N-(4-methylcyclohexyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
2-[2-(4-chlorophenyl)ethyl]-3-methyl-N-(4-methylcyclohexyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Compound characteristics
Compound ID: | C794-1316 |
Compound Name: | 2-[2-(4-chlorophenyl)ethyl]-3-methyl-N-(4-methylcyclohexyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
Molecular Weight: | 439 |
Molecular Formula: | C26 H31 Cl N2 O2 |
Smiles: | CC1CCC(CC1)NC(C1(C)Cc2ccccc2C(N1CCc1ccc(cc1)[Cl])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.464 |
logD: | 6.464 |
logSw: | -6.1193 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.05 |
InChI Key: | NHIMBWOFXXLZDO-VJVDVCSOSA-N |