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1436-44-8

1436-44-8 | Isoquinoline-1-carboxamide

CAS No: 1436-44-8 Catalog No: AG006U96 MDL No:MFCD00160679

Product Description

Catalog Number:
AG006U96
Chemical Name:
Isoquinoline-1-carboxamide
CAS Number:
1436-44-8
Molecular Formula:
C10H8N2O
Molecular Weight:
172.1833
MDL Number:
MFCD00160679
IUPAC Name:
isoquinoline-1-carboxamide
InChI:
InChI=1S/C10H8N2O/c11-10(13)9-8-4-2-1-3-7(8)5-6-12-9/h1-6H,(H2,11,13)
InChI Key:
YZDXFUGIDTUCDA-UHFFFAOYSA-N
SMILES:
NC(=O)c1nccc2c1cccc2
NSC Number:
115632

Properties

Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.064g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.187g/mol
Monoisotopic Mass:
172.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

Literature

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Effects and Mechanisms of 3α,5α,-THP on Emotion, Motivation, and Reward Functions Involving Pregnane Xenobiotic Receptor. Frontiers in neuroscience 20110101
Translocator protein (18 kDa) mediates the pro-growth effects of diazepam on Ehrlich tumor cells in vivo. European journal of pharmacology 20100125
Bacterial ortholog of mammalian translocator protein (TSPO) with virulence regulating activity. PloS one 20090101
Synthesis, fluorine-18 radiolabeling, and in vitro characterization of 1-iodophenyl-N-methyl-N-fluoroalkyl-3-isoquinoline carboxamide derivatives as potential PET radioligands for imaging peripheral benzodiazepine receptor. Bioorganic & medicinal chemistry 20080601
The scale-free dynamics of eukaryotic cells. PloS one 20080101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Peripheral benzodiazepine receptor: characterization in human T-lymphoma Jurkat cells. Molecular pharmacology 20060101
High-affinity peripheral benzodiazepine receptor ligand, PK11195, regulates protein phosphorylation in rat brain mitochondria under control of Ca(2+). Journal of neurochemistry 20050801
Peripheral-type benzodiazepine receptor (PBR) and PBR drug ligands in fibroblast and fibrosarcoma cell proliferation: role of ERK, c-Jun and ligand-activated PBR-independent pathways. Biochemical pharmacology 20040515
In vitro effects of lead ions on peripheral benzodiazepine receptors and adenylyl cyclase activity in the mantle of Mytilus galloprovincialis. Comparative biochemistry and physiology. Toxicology & pharmacology : CBP 20040201
Upregulation of 'peripheral-type' benzodiazepine receptors in the globus pallidus in a sub-acute rat model of manganese neurotoxicity. Neuroscience letters 20030925
Ligands of the peripheral benzodiazepine receptor induce apoptosis and cell cycle arrest in oesophageal cancer cells: involvement of the p38MAPK signalling pathway. British journal of cancer 20030804
The role of peripheral benzodiazepine receptors (PBRs) in CNS pathophysiology. Current medicinal chemistry 20020801
The 'peripheral-type' benzodiazepine (omega 3) receptor in hyperammonemic disorders. Neurochemistry international 20020101
PK11195, an isoquinoline carboxamide ligand of the mitochondrial benzodiazepine receptor, increased drug uptake and facilitated drug-induced apoptosis in human multidrug-resistant leukemia cells in vitro. Neoplasma 20020101
Structural and functional study of reconstituted peripheral benzodiazepine receptor. Biochemical and biophysical research communications 20010608

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