methyl 4-[(6,7-dimethoxy-2-{[4-(trifluoromethyl)phenyl]carbamothioyl}-1,2,3,4-tetrahydroisoquinolin-1-yl)methoxy]benzoate

Chemical Structure Depiction of
methyl 4-[(6,7-dimethoxy-2-{[4-(trifluoromethyl)phenyl]carbamothioyl}-1,2,3,4-tetrahydroisoquinolin-1-yl)methoxy]benzoate
Available: 364 mg
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mg
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Compound characteristics

Compound ID: C111-0146
Compound Name: methyl 4-[(6,7-dimethoxy-2-{[4-(trifluoromethyl)phenyl]carbamothioyl}-1,2,3,4-tetrahydroisoquinolin-1-yl)methoxy]benzoate
Molecular Weight: 560.59
Molecular Formula: C28 H27 F3 N2 O5 S
Smiles: COC(c1ccc(cc1)OCC1c2cc(c(cc2CCN1C(Nc1ccc(cc1)C(F)(F)F)=S)OC)OC)=O
Stereo: RACEMIC MIXTURE
logP: 5.9586
logD: 5.9586
logSw: -5.579
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 1
Polar surface area: 53.997
InChI Key: BRKIRGNUKVPCME-QHCPKHFHSA-N
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