azepan-1-yl-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone
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azepan-1-yl-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone
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CAS No:
1008039-20-0
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Formula:
C20H24N2O3S2
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Chemical Name:
azepan-1-yl-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone
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Synonyms:
1008039-20-0;SMR000013302;azepan-1-yl(2-(thiophen-2-ylsulfonyl)-1,2,3,4-tetrahydroisoquinolin-3-yl)methanone;Azepan-1-yl-[2-(thiophene-2-sulfonyl)-1,2,3,4-tetrahydro-isoquinolin-3-yl]-methanone;azepan-1-yl[2-(thiophen-2-ylsulfonyl)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanone;Oprea1_148750;MLS000034967;MLS002539456;IFLab1_005188;CHEMBL1566435;HMS1426L18;HMS2326J10;STL572957;AKOS000530553;AKOS016088769;MCULE-6792258757;ST50101977;F1274-0123;3-(azepan-1-ylcarbonyl)-2-(2-thienylsulfonyl)-1,2,3,4-tetrahydroisoquinoline;azaperhydroepinyl 2-(2-thienylsulfonyl)(3-1,2,3,4-tetrahydroisoquinolyl) keton e
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CAS No:
azepan-1-yl-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone Basic Attributes
404.6 g/mol
404.12283498 g/mol
Computed Properties
Molecular Weight:404.6
XLogP3:3.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:404.12283498
Monoisotopic Mass:404.12283498
Topological Polar Surface Area:94.3
Heavy Atom Count:27
Complexity:626
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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