N-[(2-chlorophenyl)methyl]-2-(4-methoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-(4-methoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
N-[(2-chlorophenyl)methyl]-2-(4-methoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Compound characteristics
Compound ID: | D048-0243 |
Compound Name: | N-[(2-chlorophenyl)methyl]-2-(4-methoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
Molecular Weight: | 470.97 |
Molecular Formula: | C24 H23 Cl N2 O4 S |
Smiles: | COc1ccc(cc1)S(N1Cc2ccccc2CC1C(NCc1ccccc1[Cl])=O)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.6944 |
logD: | 4.694 |
logSw: | -4.7304 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.039 |
InChI Key: | OZGBGIIRFVGQTI-QHCPKHFHSA-N |