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4-[5,6-dimethoxy-1-(4-methylphenyl)sulfonyl-3-phenylindol-2-yl]butan-2-one

4-[5,6-dimethoxy-1-(4-methylphenyl)sulfonyl-3-phenylindol-2-yl]butan-2-one structure

CAS No:
309927-66-0
Formula:
C27H27NO5S
Chemical Name:
4-[5,6-dimethoxy-1-(4-methylphenyl)sulfonyl-3-phenylindol-2-yl]butan-2-one
Synonyms:
ZINC2283774;STK536062;AKOS005467118;MCULE-9987267804;4-(1-Tosyl-3-phenyl-5,6-dimethoxy-1H-indole-2-yl)-2-butanone;4-{5,6-dimethoxy-1-[(4-methylphenyl)sulfonyl]-3-phenyl-1H-indol-2-yl}butan-2-one;309927-66-0

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4-[5,6-dimethoxy-1-(4-methylphenyl)sulfonyl-3-phenylindol-2-yl]butan-2-one Basic Attributes

Molecular Weight：

477.6 g/mol

Exact Mass：

477.16099414 g/mol

Characteristics

PSA：

83 Å²

XLogP3：

6.4733

Melting Point：

175 - 176 °C (ethanol)

Computed Properties

Molecular Weight:477.6
XLogP3:5.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:477.16099414
Monoisotopic Mass:477.16099414
Topological Polar Surface Area:83
Heavy Atom Count:34
Complexity:781
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Synthesis Route

309927-64-8

309927-66-0

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Guide of 4-[5,6-dimethoxy-1-(4-methylphenyl)sulfonyl-3-phenylindol-2-yl]butan-2-one

Basic Attributes
Characteristics
Computed Properties
Synthesis Route

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