[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone


Chemical Name: [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone
CAS Number: 849662-80-2
Product Number: AG008HJ0(AGN-PC-00G3TZ)
Synonyms:
MDL No: MFCD09970973
Molecular Formula: C28H28N2O3S
Molecular Weight: 472.5985

Identification/Properties


Computed Properties
Molecular Weight:
472.603g/mol
XLogP3:
6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
5
Exact Mass:
472.182g/mol
Monoisotopic Mass:
472.182g/mol
Topological Polar Surface Area:
92.2A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
681
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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