N-[(2-chloro-4-fluorophenyl)methyl]-2-[2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetamide
Chemical Structure Depiction of
N-[(2-chloro-4-fluorophenyl)methyl]-2-[2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetamide
N-[(2-chloro-4-fluorophenyl)methyl]-2-[2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetamide
Compound characteristics
Compound ID: | F714-0412 |
Compound Name: | N-[(2-chloro-4-fluorophenyl)methyl]-2-[2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetamide |
Molecular Weight: | 490.96 |
Molecular Formula: | C24 H21 Cl F2 N2 O3 S |
Smiles: | C1CN(C(CC(NCc2ccc(cc2[Cl])F)=O)c2ccccc12)S(c1ccc(cc1)F)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.1097 |
logD: | 5.1096 |
logSw: | -5.6784 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.125 |
InChI Key: | JPPRDHHAPGLSPJ-QHCPKHFHSA-N |