Home Aminos 3-[1-(2-{[(4-carbamimidoylphenyl)amino]methyl}-1-methyl-1H-1,3-benzodiazol-5-yl)-N-(pyridin-2-yl)formamido]propanoic acid

3-[1-(2-{[(4-carbamimidoylphenyl)amino]methyl}-1-methyl-1H-1,3-benzodiazol-5-yl)-N-(pyridin-2-yl)formamido]propanoic acid

CAS No.:
211914-51-1
Catalog Number:
AG00I41W
Molecular Formula:
C25H25N7O3
Molecular Weight:
471.5111
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
>95%(HPLC)
In Stock USA
United States
$87
- +
25mg
>95%(HPLC)
In Stock USA
United States
$155
- +
250mg
98%
In Stock USA
United States
$188
- +
1g
98%
In Stock USA
United States
$438
- +
5g
98%
In Stock USA
United States
$1313
- +
10g
98%
In Stock USA
United States
$2363
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Product Description
Catalog Number:
AG00I41W
Chemical Name:
3-[1-(2-{[(4-carbamimidoylphenyl)amino]methyl}-1-methyl-1H-1,3-benzodiazol-5-yl)-N-(pyridin-2-yl)formamido]propanoic acid
CAS Number:
211914-51-1
Molecular Formula:
C25H25N7O3
Molecular Weight:
471.5111
MDL Number:
MFCD09837830
IUPAC Name:
3-[[2-[(4-carbamimidoylanilino)methyl]-1-methylbenzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoic acid
InChI:
InChI=1S/C25H25N7O3/c1-31-20-10-7-17(25(35)32(13-11-23(33)34)21-4-2-3-12-28-21)14-19(20)30-22(31)15-29-18-8-5-16(6-9-18)24(26)27/h2-10,12,14,29H,11,13,15H2,1H3,(H3,26,27)(H,33,34)
InChI Key:
YBSJFWOBGCMAKL-UHFFFAOYSA-N
SMILES:
OC(=O)CCN(C(=O)c1ccc2c(c1)nc(n2C)CNc1ccc(cc1)C(=N)N)c1ccccn1
UNII:
I0VM4M70GC
Properties
Complexity:
757  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
471.202g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
471.521g/mol
Monoisotopic Mass:
471.202g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
150A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
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National prescribing data for dabigatran. The New Zealand medical journal 20120309
Dabigitran and the radiology department. Irish journal of medical science 20120301
The use of dabigatran immediately after atrial fibrillation ablation. Journal of cardiovascular electrophysiology 20120301
What's a mother to do? Journal of cardiovascular electrophysiology 20120301
Dabigatran etexilate: what do hospitalists need to know? Journal of hospital medicine 20120301
Net clinical benefit of new oral anticoagulants (dabigatran, rivaroxaban, apixaban) versus no treatment in a 'real world' atrial fibrillation population: a modelling analysis based on a nationwide cohort study. Thrombosis and haemostasis 20120301
Using the HEMOCLOT direct thrombin inhibitor assay to determine plasma concentrations of dabigatran. Blood coagulation & fibrinolysis : an international journal in haemostasis and thrombosis 20120301
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Cost-effectiveness of dabigatran compared with warfarin for stroke prevention in patients with atrial fibrillation and prior stroke or transient ischemic attack. Stroke 20120301
What's the 'go to' anticoagulant for stroke prevention in atrial fibrillation? Thrombosis and haemostasis 20120301
New directions in anticoagulation. The American journal of medicine 20120301
Dabigatran (Pradaxa). AJNR. American journal of neuroradiology 20120301
A new generation of oral direct anticoagulants. Arteriosclerosis, thrombosis, and vascular biology 20120301
Review of atrial fibrillation outcome trials of oral anticoagulant and antiplatelet agents. Europace : European pacing, arrhythmias, and cardiac electrophysiology : journal of the working groups on cardiac pacing, arrhythmias, and cardiac cellular electrophysiology of the European Society of Cardiology 20120301
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More on acutely injured patients receiving dabigatran. The New England journal of medicine 20120301
Bleeding risk with dabigatran in the frail elderly. The New England journal of medicine 20120301
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