2-(3-Methyl-4-phenyl-1-piperazinyl)-N-(3-nitrophenyl)acetamide (2 E)-2-butenedioate (1:2)
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2-(3-Methyl-4-phenyl-1-piperazinyl)-N-(3-nitrophenyl)acetamide (2 E)-2-butenedioate (1:2)
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CAS No:
118989-84-7
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Formula:
C27H30N4O11
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Chemical Name:
2-(3-Methyl-4-phenyl-1-piperazinyl)-N-(3-nitrophenyl)acetamide (2 E)-2-butenedioate (1:2)
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CAS No:
2-(3-Methyl-4-phenyl-1-piperazinyl)-N-(3-nitrophenyl)acetamide (2 E)-2-butenedioate (1:2) Basic Attributes
586.54700
586.19110779
Computed Properties
Molecular Weight:586.5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:8
Exact Mass:586.19110779
Monoisotopic Mass:586.19110779
Topological Polar Surface Area:231
Heavy Atom Count:42
Complexity:609
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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