Pyrrolo[2,3-b]pyrrol-2(1H)-one, hexahydro-5-(2-hydroxyphenyl)-3a-methyl-6-[3-(trifluoromethyl)benzoyl]-, (3aR)-
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Pyrrolo[2,3-b]pyrrol-2(1H)-one, hexahydro-5-(2-hydroxyphenyl)-3a-methyl-6-[3-(trifluoromethyl)benzoyl]-, (3aR)-
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CAS No:
956964-50-4
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Formula:
C21H19F3N2O3
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Chemical Name:
Pyrrolo[2,3-b]pyrrol-2(1H)-one, hexahydro-5-(2-hydroxyphenyl)-3a-methyl-6-[3-(trifluoromethyl)benzoyl]-, (3aR)-
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Synonyms:
(3AR)-5-(2-HYDROXYPHENYL)-3A-METHYL-6-[3-(TRIFLUOROMETHYL)BENZOYL]HEXAHYDROPYRROLO[2,3-B]PYRROL-2(1H)-ONE;
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CAS No:
Pyrrolo[2,3-b]pyrrol-2(1H)-one, hexahydro-5-(2-hydroxyphenyl)-3a-methyl-6-[3-(trifluoromethyl)benzoyl]-, (3aR)- Basic Attributes
404.38200
404.13477696
Computed Properties
Molecular Weight:404.4
XLogP3:3.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:404.13477696
Monoisotopic Mass:404.13477696
Topological Polar Surface Area:69.6
Heavy Atom Count:29
Complexity:670
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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