2-[(6-butoxypyridin-3-yl)amino]-4-chloro-benzoic acid

Modify Date: 2025-09-28 14:34:00

2-[(6-butoxypyridin-3-yl)amino]-4-chloro-benzoic acid Structure
2-[(6-butoxypyridin-3-yl)amino]-4-chloro-benzoic acid structure
Common Name 2-[(6-butoxypyridin-3-yl)amino]-4-chloro-benzoic acid
CAS Number 6940-93-8 Molecular Weight 320.77100
Density 1.3g/cm3 Boiling Point 467.4ºC at 760 mmHg
Molecular Formula C16H17ClN2O3 Melting Point N/A
MSDS N/A Flash Point 236.5ºC

 Names

Name 2-[(6-butoxypyridin-3-yl)amino]-4-chlorobenzoic acid

 Chemical & Physical Properties

Density 1.3g/cm3
Boiling Point 467.4ºC at 760 mmHg
Molecular Formula C16H17ClN2O3
Molecular Weight 320.77100
Flash Point 236.5ºC
Exact Mass 320.09300
PSA 71.45000
LogP 4.42870
Index of Refraction 1.615
InChIKey VJFNMPCCIPJOHB-UHFFFAOYSA-N
SMILES CCCCOc1ccc(Nc2cc(Cl)ccc2C(=O)O)cn1

 Synthetic Route

~%

2-[(6-butoxypyridin-3-yl)amino]-4-chloro-benzoic acid Structure

2-[(6-butoxypyr...

CAS#:6940-93-8

Literature: Besly; Goldberg Journal of the Chemical Society, <1954> 2448, 2452

 Precursor & DownStream

Precursor  2

DownStream  0

 Bioassay

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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
Name: Specificity screen against TRPC6 for compounds that activate transient receptor poten...
Source: Johns Hopkins Ion Channel Center
Target: short transient receptor potential channel 6 [Mus musculus]
External Id: TRPC4_AG_Counter_C6
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: Specificity screen against TRPC6 for compounds that inhibit transient receptor potent...
Source: Johns Hopkins Ion Channel Center
Target: short transient receptor potential channel 6 [Mus musculus]
External Id: TRPC4_Inh_Counter_C6
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: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
Name: Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
Source: ChEMBL
Target: Klebsiella pneumoniae
External Id: CHEMBL4296186
Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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