[2-(cyclohexylamino)-2-oxoethyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate
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[2-(cyclohexylamino)-2-oxoethyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate
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CAS No:
474371-63-6
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Formula:
C24H28N2O5S
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Chemical Name:
[2-(cyclohexylamino)-2-oxoethyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate
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Synonyms:
Oprea1_788578;ZINC3317176;AKOS033638198;MCULE-6510688046;Z18716015;(cyclohexylcarbamoyl)methyl 3-(1,2,3,4-tetrahydroisoquinoline-2-sulfonyl)benzoate;474371-63-6
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CAS No:
[2-(cyclohexylamino)-2-oxoethyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate Basic Attributes
456.6 g/mol
456.17189317 g/mol
Computed Properties
Molecular Weight:456.6
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:456.17189317
Monoisotopic Mass:456.17189317
Topological Polar Surface Area:101
Heavy Atom Count:32
Complexity:759
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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