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rel-(2R,3R)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-2,3-dihydro-3-phenyl-1,4-benzodioxin-2-methanamine

rel-(2R,3R)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-2,3-dihydro-3-phenyl-1,4-benzodioxin-2-methanamine structure

CAS No:
130905-04-3
Formula:
C25H27NO5
Chemical Name:
rel-(2R,3R)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-2,3-dihydro-3-phenyl-1,4-benzodioxin-2-methanamine
Synonyms:
1,4-Benzodioxin-2-methanamine,N-[2-(2,6-dimethoxyphenoxy)ethyl]-2,3-dihydro-3-phenyl-,(2R,3R)-rel-;1,4-Benzodioxin-2-methanamine,N-[2-(2,6-dimethoxyphenoxy)ethyl]-2,3-dihydro-3-phenyl-,trans-;rel-(2R,3R)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-2,3-dihydro-3-phenyl-1,4-benzodioxin-2-methanamine

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rel-(2R,3R)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-2,3-dihydro-3-phenyl-1,4-benzodioxin-2-methanamine Basic Attributes

Molecular Weight：

421.5 g/mol

Exact Mass：

421.49

Characteristics

PSA：

58.2 Å²

Drug Information

MeSH Entry Terms：

phendioxan

Computed Properties

Molecular Weight:421.5
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:421.18892296
Monoisotopic Mass:421.18892296
Topological Polar Surface Area:58.2
Heavy Atom Count:31
Complexity:502
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of rel-(2R,3R)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-2,3-dihydro-3-phenyl-1,4-benzodioxin-2-methanamine

Basic Attributes
Characteristics
Drug Information
Computed Properties

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