2-cyano-4-(4-nitrophenyl)-2-[2-(4-nitrophenyl)ethyl]butanamide

Modify Date: 2026-07-01 18:19:16

2-cyano-4-(4-nitrophenyl)-2-[2-(4-nitrophenyl)ethyl]butanamide Structure
2-cyano-4-(4-nitrophenyl)-2-[2-(4-nitrophenyl)ethyl]butanamide structure
Common Name 2-cyano-4-(4-nitrophenyl)-2-[2-(4-nitrophenyl)ethyl]butanamide
CAS Number 5345-32-4 Molecular Weight 382.37000
Density 1.349g/cm3 Boiling Point 679.3ºC at 760 mmHg
Molecular Formula C19H18N4O5 Melting Point N/A
MSDS N/A Flash Point 364.6ºC

 Names

Name 2-cyano-4-(4-nitrophenyl)-2-[2-(4-nitrophenyl)ethyl]butanamide
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.349g/cm3
Boiling Point 679.3ºC at 760 mmHg
Molecular Formula C19H18N4O5
Molecular Weight 382.37000
Flash Point 364.6ºC
Exact Mass 382.12800
PSA 158.52000
LogP 4.81038
Index of Refraction 1.623
InChIKey WDOBYVRAPXBESG-UHFFFAOYSA-N
SMILES N#CC(CCc1ccc([N+](=O)[O-])cc1)(CCc1ccc([N+](=O)[O-])cc1)C(N)=O

 Precursor & DownStream

Precursor  2

DownStream  0

 Bioassay

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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
Name: qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
Source: NCGC
Target: TDP1 protein [Homo sapiens]
External Id: TDP1100
Name: qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
Source: NCGC
Target: TDP1 protein [Homo sapiens]
External Id: TDP1101
Name: Schnurri-3 Inhibitors: specific inducers of adult bone formation Measured in Cell-Bas...
Source: Broad Institute
Target: N/A
External Id: 2134-01_Inhibitor_SinglePoint_HTS_Activity_Set2
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
Name: High throughput screen for small molecule inhibitors of a hypoxia-regulated fluoresce...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: N/A
External Id: HMS1149-MLP
Name: qHTS for Inhibitors of AMA1-RON; Towards Development of Antimalarial Drug Lead: Prima...
Source: NCGC
Target: apical membrane antigen 1, AMA1 [Plasmodium falciparum 3D7]
External Id: AMA1100
Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: abhydrolase domain-containing protein 4 isoform 1 [Mus musculus]
External Id: ABHD4_INH_FP_1536_1X%INH PRUN
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 Synonyms

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