[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 2-(thiophen-2-ylsulfonylamino)benzoate
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![[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 2-(thiophen-2-ylsulfonylamino)benzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f78b18fff6674808ac9f12413f42fe58.png "[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 2-(thiophen-2-ylsulfonylamino)benzoate")
[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 2-(thiophen-2-ylsulfonylamino)benzoate
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CAS No:
474913-80-9
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Formula:
C22H20N2O5S2
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Chemical Name:
[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 2-(thiophen-2-ylsulfonylamino)benzoate
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Synonyms:
Oprea1_083618;ZINC3340124;AKOS033697361;MCULE-1855800948;Z19641483;2-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl 2-(thiophene-2-sulfonamido)benzoate;474913-80-9
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CAS No:
[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 2-(thiophen-2-ylsulfonylamino)benzoate Basic Attributes
456.5 g/mol
456.08136409 g/mol
Computed Properties
Molecular Weight:456.5
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:456.08136409
Monoisotopic Mass:456.08136409
Topological Polar Surface Area:129
Heavy Atom Count:31
Complexity:754
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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