Benzenepropanoic acid, 3-cyano-a-[1-[[4-(4-pyridinyl)benzoyl]aMino]ethyl]-, Methyl ester, [R-(R*,R*)]-
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![Benzenepropanoic acid, 3-cyano-a-[1-[[4-(4-pyridinyl)benzoyl]aMino]ethyl]-, Methyl ester, [R-(R*,R*)]- structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ea6133db261a4520a5e955a02ffd86f0.png "Benzenepropanoic acid, 3-cyano-a-[1-[[4-(4-pyridinyl)benzoyl]aMino]ethyl]-, Methyl ester, [R-(R*,R*)]-")
Benzenepropanoic acid, 3-cyano-a-[1-[[4-(4-pyridinyl)benzoyl]aMino]ethyl]-, Methyl ester, [R-(R*,R*)]-
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CAS No:
193152-99-7
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Formula:
C25H23N3O3
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Chemical Name:
Benzenepropanoic acid, 3-cyano-a-[1-[[4-(4-pyridinyl)benzoyl]aMino]ethyl]-, Methyl ester, [R-(R*,R*)]-
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Synonyms:
Benzenepropanoic acid, 3-cyano-a-[1-[[4-(4-pyridinyl)benzoyl]amino]ethyl]-, methyl ester, [R-(R*,R*)]-
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CAS No:
Benzenepropanoic acid, 3-cyano-a-[1-[[4-(4-pyridinyl)benzoyl]aMino]ethyl]-, Methyl ester, [R-(R*,R*)]- Basic Attributes
413.46842
413.174
Computed Properties
Molecular Weight:413.5
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:413.17394160
Monoisotopic Mass:413.17394160
Topological Polar Surface Area:92.1
Heavy Atom Count:31
Complexity:644
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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