[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-(4-fluorophenyl)-1-phenylpyrazole-4-carboxylate
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![[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-(4-fluorophenyl)-1-phenylpyrazole-4-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/be931c2ce9394710967f5f173379c870.png "[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-(4-fluorophenyl)-1-phenylpyrazole-4-carboxylate")
[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-(4-fluorophenyl)-1-phenylpyrazole-4-carboxylate
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CAS No:
477522-19-3
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Formula:
C27H22FN3O3
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Chemical Name:
[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-(4-fluorophenyl)-1-phenylpyrazole-4-carboxylate
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Synonyms:
ZINC3170496;AKOS033651648;MCULE-4217981929;Z18960036;2-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl 3-(4-fluorophenyl)-1-phenyl-1H-pyrazole-4-carboxylate;477522-19-3
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CAS No:
[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-(4-fluorophenyl)-1-phenylpyrazole-4-carboxylate Basic Attributes
455.5 g/mol
455.16451973 g/mol
Computed Properties
Molecular Weight:455.5
XLogP3:4.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:455.16451973
Monoisotopic Mass:455.16451973
Topological Polar Surface Area:64.4
Heavy Atom Count:34
Complexity:707
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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