cyanomethyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate
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cyanomethyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate
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CAS No:
736149-58-9
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Formula:
C18H16N2O4S
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Chemical Name:
cyanomethyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate
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Synonyms:
ZINC3353725;AKOS033638172;MCULE-4788503982;Z18715784;cyanomethyl 3-(1,2,3,4-tetrahydroisoquinoline-2-sulfonyl)benzoate;736149-58-9
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CAS No:
cyanomethyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate Basic Attributes
356.4 g/mol
356.08307817 g/mol
Computed Properties
Molecular Weight:356.4
XLogP3:2.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:356.08307817
Monoisotopic Mass:356.08307817
Topological Polar Surface Area:95.8
Heavy Atom Count:25
Complexity:633
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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