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DIALLYLTRYPTAMINE

DIALLYLTRYPTAMINE structure

DIALLYLTRYPTAMINE 

structure
  • CAS No:

    299-89-8

  • Formula:

    C16H22N4O4S

  • Chemical Name:

    DIALLYLTRYPTAMINE

  • Synonyms:

    Thianeuron;ACETIAMINE;DIALLYLTRPTAMINE;DIALLYLTRYPTAMINE;N-(2-(1H-indol-3-yl)ethyl)-N-allylprop-2-en-1-aMine;3-Acetylthio-4-[(4-amino-2-methyl-5-pyrimidinyl)methyl-N-formylamino]-3-pentenyl=acetate;3-Acetylthio-4-[(4-amino-2-methyl-5-pyrimidinyl)methyl-N-formylamino]-3-pentenylacetate

DIALLYLTRYPTAMINE Basic Attributes

366.43500

366.13600

Characteristics

140.78000

3.00710

1.271g/cm3

122-123° (dec); mp 123-124°

595.3ºC at 760mmHg

313.8ºC

1.582

Drug Information

diacetylthiamine

Computed Properties

Molecular Weight:366.4
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:366.13617637
Monoisotopic Mass:366.13617637
Topological Polar Surface Area:141
Heavy Atom Count:25
Complexity:526
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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