Catalog No.:AA00GA1V

85452-79-5 | (Z)-3-(1H-Indol-3-yl)acrylonitrile

Name: Name:(Z)-3-(1H-Indol-3-yl)acrylonitrile
Brand: AABLOCKS
SKU: AA00GA1V
Availability: InStock
Rating: 90 (10 reviews)

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250mg

95%

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$129.00 $90.00

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Technical Information
Properties
Upstream Synthesis Route
Literature
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Technical Information
Properties
Upstream Synthesis Route
Literature

Technical Information

Catalog Number:

AA00GA1V

Chemical Name:

(Z)-3-(1H-Indol-3-yl)acrylonitrile

CAS Number:

85452-79-5

Molecular Formula:

C11H8N2

Molecular Weight:

168.1946

MDL Number:

MFCD28125617

SMILES:

N#C/C=C\c1c[nH]c2c1cccc2

Properties

Computed Properties

Complexity:

248

Covalently-Bonded Unit Count:

Defined Bond Stereocenter Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Rotatable Bond Count:

XLogP3:

2.4

Upstream Synthesis Route

487-89-8

372-09-8

85452-79-5

85452-78-4

[1]ArchivderPharmazie,1994,vol.327,#6,p.349-358

[2]JournalofMedicinalChemistry,2011,vol.54,#15,p.5320-5334

487-89-8

2537-48-6

85452-79-5

85452-78-4

[1]Tetrahedron,1982,vol.38,#20,p.3019-3022

Literature

Title: Tryptophan 2,3-dioxygenase (TDO) inhibitors. 3-(2-(pyridyl)ethenyl)indoles as potential anticancer immunomodulators.

Journal: Journal of medicinal chemistry 20110811

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SDS