3-benzyl-7-tert-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
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3-benzyl-7-tert-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
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CAS No:
354992-66-8
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Formula:
C29H30N2O2S2
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Chemical Name:
3-benzyl-7-tert-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
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Synonyms:
3-benzyl-7-tert-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one;Oprea1_001075;STK698854;AKOS005521507;MCULE-5054987123;AJ-292/13487025;3-benzyl-7-(tert-butyl)-2-((2-oxo-2-phenylethyl)thio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one;354992-66-8
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CAS No:
3-benzyl-7-tert-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one Basic Attributes
502.6907
502.175
Computed Properties
Molecular Weight:502.7
XLogP3:7.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:502.17487055
Monoisotopic Mass:502.17487055
Topological Polar Surface Area:103
Heavy Atom Count:35
Complexity:810
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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