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Type HazMat fee for 500 gram (Estimated)
Excepted Quantity USD 0.00
Limited Quantity USD 15-60
Inaccessible (Haz class 6.1), Domestic USD 80+
Inaccessible (Haz class 6.1), International USD 150+
Accessible (Haz class 3, 4, 5 or 8), Domestic USD 100+
Accessible (Haz class 3, 4, 5 or 8), International USD 200+
Chemical Structure| 3731-52-0 Chemical Structure| 3731-52-0

Structure of 3-Picolylamine
CAS No.: 3731-52-0

Chemical Structure| 3731-52-0

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Synonyms: Picolamine; 3-Pyridinemethanamine; NSC 59706

4.5 *For Research Use Only !

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Product Citations

Product Citations

Ingraham, Charles H. IV ; Stalinska, Joanna ; Carson, Sean C. ; Colley, Susan B. ; Rak, Monika ; Lassak, Adam , et al.

Abstract: Glioblastomas are highly aggressive brain tumors for which therapeutic options are very limited. In a quest for new anti-glioblastoma drugs, we focused on specific structural modifications to the benzoyl-phenoxy-acetamide (BPA) structure present in a common lipid-lowering drug, fenofibrate, and in our first prototype glioblastoma drug, PP1. Here, we propose extensive computational analyses to improve the selection of the most effective glioblastoma drug candidates. Initially, over 100 structural BPA variations were analyzed and their physicochemical properties, such as water solubility (- logS), calculated partition coefficient (ClogP), probability for BBB crossing (BBB_SCORE), probability for CNS penetration (CNS-MPO) and calculated cardiotoxicity (hERG), were evaluated. This integrated approach allowed us to select pyridine variants of BPA that show improved BBB penetration, water solubility, and low cardiotoxicity. Herein the top 24 compounds were synthesized and analyzed in cell culture. Six of them demonstrated glioblastoma toxicity with IC50 ranging from 0.59 to 3.24 µM. Importantly, one of the compounds, HR68, accumulated in the brain tumor tissue at 3.7 ± 0.5 µM, which exceeds its glioblastoma IC50 (1.17 µM) by over threefold.

Purchased from AmBeed: ; ; ; ; ; ; ; ; ; 2706-56-1 ; ; ; ; ; ; ; ; 20173-24-4 ; ; ; ; ; ; ; ; 42017-89-0 ; 90-45-9

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Product Details of 3-Picolylamine

CAS No. :3731-52-0
Formula : C6H8N2
M.W : 108.14
SMILES Code : NCC1=CC=CN=C1
Synonyms :
Picolamine; 3-Pyridinemethanamine; NSC 59706
MDL No. :MFCD00006412
InChI Key :HDOUGSFASVGDCS-UHFFFAOYSA-N
Pubchem ID :31018

Safety of 3-Picolylamine

GHS Pictogram:
Signal Word:Danger
Hazard Statements:H314
Precautionary Statements:P501-P264-P280-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P405
Class:8
UN#:2735
Packing Group:

Isoform Comparison

Protocol

Bio Calculators
Preparing Stock Solutions 1mg 5mg 10mg

1 mM

5 mM

10 mM

9.25mL

1.85mL

0.92mL

46.24mL

9.25mL

4.62mL

92.47mL

18.49mL

9.25mL

 

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