N-[(4-chlorophenyl)methyl]-2-(4-fluorophenyl)-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-(4-fluorophenyl)-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
N-[(4-chlorophenyl)methyl]-2-(4-fluorophenyl)-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Compound characteristics
Compound ID: | L678-0257 |
Compound Name: | N-[(4-chlorophenyl)methyl]-2-(4-fluorophenyl)-3-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
Molecular Weight: | 422.89 |
Molecular Formula: | C24 H20 Cl F N2 O2 |
Smiles: | CC1(Cc2ccccc2C(N1c1ccc(cc1)F)=O)C(NCc1ccc(cc1)[Cl])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.6352 |
logD: | 4.6352 |
logSw: | -4.8902 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 39.735 |
InChI Key: | IAGNWAKPKMBTPC-DEOSSOPVSA-N |