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Dabigatran

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Dabigatran / CAS : 211914-51-1

Appearance Yellow brown solid UN 0
HS 29420000 DG Class 0
Synonyms Dabigatran (Bibr 953); 3-[[2-[(4-Carbamimidoylanilino)Methyl]-1-Methylbenzimidazole-5-Carbonyl]-Pyridin-2-Ylamino]Propanoic Acid; Unii-I0Vm4M70Gc; Bibr 953,Dabigatran,Bibr953; Bibr-953; Bibr 953Zw; Bibr 953 (Dabigatran,Pradaxa); 3-[[2-[[(4-Carbamimidoylphenyl)Amino]Methyl]-1-Met; Bibr 953(Dabigatran); N-[[2-[[[4-(Aminoiminomethyl)Phenyl]Amino]Methyl]-1-Methyl-1H-Benzo[D]Imidazol-5-Yl]Carbonyl]-N-Pyridin-2-Yl-Beta-Alanine; N-[(2-{[(4-Carbamimidoylphenyl)Amino]Methyl}-1-Methyl-1Hbenzimidazol-; 5-Yl)Carbonyl]-N-Pyridin-2-Yl-Beta-Alanine; Bibr 953 (Dabigatran, Pradaxa); 3-[[2-[[(4-Carbamimidoylphenyl)Amino]Methyl]-1-Methyl-Benzoimidazole-5-Carbonyl]-Pyridin-2-Yl-Amino]; Bib-953
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Properties

Summary

Formula
C25H25N7O3
Molecular Mass
471.51100
Exact Mass
471.20200
PSA
150.22000
Logp
3.85900
IUPAC
3-[[2-[(4-carbamimidoylanilino)methyl]-1-methylbenzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoic acid
SMILES
CN1C2=C(C=C(C=C2)C(=O)N(CCC(=O)O)C3=CC=CC=N3)N=C1CNC4=CC=C(C=C4)C(=N)N

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Blood System Drugs

Chemical and Physical Properties

Melting Point
268-272ºC
Density
1.38 g/cm3
Boiling Point
797.1ºC at 760 mmHg
Flash Point
435.9ºC
Appearance
Yellow brown solid

Export information

HS Code
29420000
Export Rebate
13%
UN No.
0
DG-Class
0

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