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Home > Products > Food & Nutrition > Nutritional Ingredients > N-[[2-[[[4-(Aminoiminomethyl)phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-(2-pyridinyl)-beta-alanine ethyl ester hydrochloride
N-[[2-[[[4-(Aminoiminomethyl)phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-(2-pyridinyl)-beta-alanine ethyl ester hydrochloride structure, CAS 211914-50-0

N-[[2-[[[4-(Aminoiminomethyl)phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-(2-pyridinyl)-beta-alanine ethyl ester hydrochloride

CAS Number211914-50-0

SynonymsDabigatran (ethyl ester hydrochloride); Dabigatran Ethyl Ester Hydrochloride Salt

Molecular FormulaC27H30ClN7O3

Molecular Weight536.025

Purity98%%

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Cat. No.: 2A-1172611 Purity: 98%%
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Quality Control of [ 211914-50-0 ] Purity: 98%% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number211914-50-0
Catalog No.2A-1172611
Chinese NameN-[[2-[[[4-(氨基亚氨基甲基)苯基]氨基]甲基]-1-甲基-1H-苯并咪唑-5-基]羰基]-n-(2-吡啶)-beta-丙氨酸乙酯盐酸盐
SynonymsDabigatran (ethyl ester hydrochloride); Dabigatran Ethyl Ester Hydrochloride Salt
Molecular FormulaC27H30ClN7O3
Molecular Weight536.025
Purity98%
Storage Condition2-8℃
ApplicationDabigatran ethyl ester hydrochloride is a potent ribosyldihydronicotinamide dehydrogenase (NQO2) inhibitor with an IC50 value of 0.8 μM. Also an inhibitor of thrombin.
PubChem ID30290489
SMILESCCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc1ccc(C(=N)N)cc1)n2C)c1ccccn1.Cl
InChIInChI=1S/C27H29N7O3.ClH/c1-3-37-25(35)13-15-34(23-6-4-5-14-30-23)27(36)19-9-12-22-21(16-19)32-24(33(22)2)17-31-20-10-7-18(8-11-20)26(28)29;/h4-12,14,16,31H,3,13,15,17H2,1-2H3,(H3,28,29);1H
InChI KeyFHWBKCGBULSVFO-UHFFFAOYSA-N
Transport InfoProduct name: N-[[2-[[[4-(aminoiminomethyl)phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-n-(2-pyridine)-beta-alanine ethyl ester hydrochloride
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