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16060-65-4 | Benzoic acid, 4-[(aminoiminomethyl)amino]-
CAS No: 16060-65-4 Catalog No: AG001S30 MDL No:
Product Description
Catalog Number:
AG001S30
Chemical Name:
Benzoic acid, 4-[(aminoiminomethyl)amino]-
CAS Number:
16060-65-4
Molecular Formula:
C8H9N3O2
Molecular Weight:
179.1760
IUPAC Name:
4-(diaminomethylideneamino)benzoic acid
InChI:
InChI=1S/C8H9N3O2/c9-8(10)11-6-3-1-5(2-4-6)7(12)13/h1-4H,(H,12,13)(H4,9,10,11)
InChI Key:
SXTSBZBQQRIYCU-UHFFFAOYSA-N
SMILES:
NN=CNc1ccc(cc1)C(=O)O
EC Number:
813-388-9
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
179.179g/mol
Monoisotopic Mass:
179.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
Literature
| Title | Journal |
|---|---|
| The modulation of TRPM7 currents by nafamostat mesilate depends directly upon extracellular concentrations of divalent cations. | Molecular brain 20100101 |
| Camostat attenuates airway epithelial sodium channel function in vivo through the inhibition of a channel-activating protease. | The Journal of pharmacology and experimental therapeutics 20090501 |
| Determination of 4'-carbomethoxyphenyl 4-guanidinobenzoate mesylate by HPLC and identification of its related substances by LC-MS-MS. | Journal of chromatographic science 20090101 |
| Nafamostat mesilate reversibly blocks acid-sensing ion channel currents. | Biochemical and biophysical research communications 20071109 |
| Thermodynamic analysis reveals structural rearrangement during the acylation step in human trypsin 4 on 4-methylumbelliferyl 4-guanidinobenzoate substrate analogue. | The Journal of biological chemistry 20060505 |
| Combinatorial approaches towards the discovery of new tryptase inhibitors. | Bioorganic & medicinal chemistry letters 20050315 |
| Inhibition of prostasin secretion by serine protease inhibitors in the kidney. | Journal of the American Society of Nephrology : JASN 20030101 |
| Synthesis and biological activity of analogues of the antidiabetic/antiobesity agent 3-guanidinopropionic acid: discovery of a novel aminoguanidinoacetic acid antidiabetic agent. | Journal of medicinal chemistry 20010412 |
| Design and synthesis of benzoic acid derivatives as influenza neuraminidase inhibitors using structure-based drug design. | Journal of medicinal chemistry 19971205 |
| Mechanisms of the hyperkalaemia caused by nafamostat mesilate: effects of its two metabolites on Na+ and K+ transport properties in the rabbit cortical collecting duct. | British journal of pharmacology 19940101 |
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