Name: Name:Phenol, 4-(2-amino-1-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-
Brand: AABLOCKS
SKU: AA000TBE
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA000TBE

Chemical Name: Phenol, 4-(2-amino-1-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-

CAS Number: 126861-72-1

Molecular Formula: C13H12N4O

Molecular Weight: 240.2606

MDL Number: MFCD00871901

SMILES: Oc1ccc(cc1)c1cnc2c(c1)n(C)c(n2)N

Properties

Complexity: 293

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 18

Hydrogen Bond Acceptor Count: 4

Hydrogen Bond Donor Count: 2

Isotope Atom Count: 0

Rotatable Bond Count: 1

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 1.9

Literature fold

Title: Aberrant activation of M phase proteins by cell proliferation-evoking carcinogens after 28-day administration in rats.

Journal: Toxicology letters20130607

Title: Hollow fibre-supported liquid membrane extraction and LC-MS/MS detection for the analysis of heterocyclic amines in urine samples.

Journal: Molecular nutrition & food research20091201

Title: Quantitative investigation of the role of breast cancer resistance protein (Bcrp/Abcg2) in limiting brain and testis penetration of xenobiotic compounds.

Journal: Drug metabolism and disposition: the biological fate of chemicals20080601

Title: Liquid chromatography-tandem mass spectrometry analysis of 2-amino-1-methyl-6-(4-hydroxyphenyl)imidazo[4,5-b]pyridine in cooked meats.

Journal: Journal of agricultural and food chemistry20071031

Title: Mouse lung CYP1A1 catalyzes the metabolic activation of 2-amino-1-methyl-6-phenylimidazo[4,5-b]pyridine (PhIP).

Journal: Carcinogenesis20070301

Title: A comprehensive investigation of 2-amino-1-methyl-6-phenylimidazo[4,5-b]pyridine (PhIP) metabolism in the mouse using a multivariate data analysis approach.

Journal: Chemical research in toxicology20070301

Title: Differential metabolism of 2-amino-1-methyl-6-phenylimidazo[4,5-b]pyridine (PhIP) in mice humanized for CYP1A1 and CYP1A2.

Journal: Chemical research in toxicology20050901

Title: Relationship between content and activity of cytochrome P450 and induction of heterocyclic amine DNA adducts in human liver samples in vivo and in vitro.

Journal: Cancer epidemiology, biomarkers & prevention : a publication of the American Association for Cancer Research, cosponsored by the American Society of Preventive Oncology20040601

Title: Analytical method of 2-amino-1-methyl-6-phenylimidazo[4,5-b]pyridine in human hair by column-switching liquid chromatography-mass spectrometry.

Journal: Journal of chromatography. B, Analytical technologies in the biomedical and life sciences20040425

Title: Metabolism of heterocyclic aromatic amines by human hepatocytes and cytochrome P4501A2.

Journal: Mutation research20020930

Title: Differential metabolism of 2-amino-1-methyl-6-phenylimidazo[4,5-b]pyridine in rat and human hepatocytes.

Journal: Carcinogenesis20020101

Title: Primary cultures of prostate cells and their ability to activate carcinogens.

Journal: Prostate cancer and prostatic diseases20020101

Title: Enzymatic characterization and interspecies difference of phenol sulfotransferases, ST1A forms.

Journal: Drug metabolism and disposition: the biological fate of chemicals20010301

126861-72-1 | Phenol, 4-(2-amino-1-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-