甲基3-(2-((((4-(N-(((己氧基氧基)羰基)氨基甲酰基)苯基)氨基)甲基)-1-甲基-N-(吡啶-2-基)-1H-苯并[D]咪唑-5-羧酰胺基)丙酸酯(达比加群酯杂质)
Dabigatran iMpurity J
CAS: 211915-00-3
Molecular Formula: C33H39N7O5
甲基3-(2-((((4-(N-(((己氧基氧基)羰基)氨基甲酰基)苯基)氨基)甲基)-1-甲基-N-(吡啶-2-基)-1H-苯并[D]咪唑-5-羧酰胺基)丙酸酯(达比加群酯杂质) - Names and Identifiers
| Name | Dabigatran iMpurity J |
| Synonyms | Dabigatran iMpurity J Dabigatran etexilate-15 Dabigatran etexilate-008 Dabigatran Impurity 9 (DABRC-09) methyl (E)-3-(2-(((4-(N'-((hexyloxy)carbonyl)carbamimidoyl)phenyl)amino)methyl)-1-methyl-N-(pyridin-2-yl)-1H-benzo[d]imidazole-5-carboxamido)propanoate β-Alanine, N-[[2-[[[4-[[[(hexyloxy)carbonyl]amino]iminomethyl]phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-2-pyridinyl-, methyl ester methyl (Z)-3-(2-(((4-(N'-((hexyloxy)carbonyl)carbamimidoyl)phenyl)amino)methyl)-1-methyl-N-(pyridin-2-yl)-1H-benzo[d]imidazole-5-carboxamido)propanoate Β-?ALANINE, N-?[[2-?[[[4-?[[[(HEXYLOXY)?CARBONYL]?AMINO]?IMINOMETHYL]?PHENYL]?AMINO]?METHYL]?-?1-?METHYL-?1H-?BENZIMIDAZOL-?5-?YL]?CARBONYL]?-?N-?2-?PYRIDINYL-?, METHYL ESTER |
| CAS | 211915-00-3 |
甲基3-(2-((((4-(N-(((己氧基氧基)羰基)氨基甲酰基)苯基)氨基)甲基)-1-甲基-N-(吡啶-2-基)-1H-苯并[D]咪唑-5-羧酰胺基)丙酸酯(达比加群酯杂质) - Physico-chemical Properties
| Molecular Formula | C33H39N7O5 |
| Molar Mass | 613.71 |
| Density | 1.25±0.1 g/cm3(Predicted) |
| Melting Point | >62°C (dec.) |
| Solubility | Acetonitrile (Slightly), DMSO (Slightly) |
| Appearance | Solid |
| Color | White to Pale Beige |
| pKa | 9.88±0.46(Predicted) |
| Storage Condition | -20°C Freezer, Under inert atmosphere |
![甲基3-(2-((((4-(N-(((己氧基氧基)羰基)氨基甲酰基)苯基)氨基)甲基)-1-甲基-N-(吡啶-2-基)-1H-苯并[D]咪唑-5-羧酰胺基)丙酸酯(达比加群酯杂质)](http://res.chembk.com/assets/images/structure/211915-00-3.gif)
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甲基3-(2-((((4-(N-(((己氧基氧基)羰基)氨基甲酰基)苯基)氨基)甲基)-1-甲基-N-(吡啶-2-基)-1H-苯并[D]咪唑-5-羧酰胺基)丙酸酯(达比加群酯杂质)
((5-双环[2.2.1]庚基-2-乙基)乙基)三乙氧基硅烷
异丙基溴化镁, 3.0 M IN 2-METHYLTETRAHYDROFURAN, SPCSEAL
3-羟基环己烷-1-酮
TETRA-N-BUTYLAMMONIUM HEXAFLUOROPHOSPHATE
叔丁基4-(三甲基硅基氧基)-5,6-二氢吡啶-1(2H)-甲酸酯
2,5-二甲氧基-4-[(4-硝基苯基)偶氮]苯胺
2-甲基-5-溴苯甲酰氯
3-甲基-4-甲氧基苯胺
2-(呋喃-2-基亚甲基)-6-羟基-1-苯并呋喃-3-酮
((5-双环[2.2.1]庚基-2-乙基)乙基)三乙氧基硅烷
异丙基溴化镁, 3.0 M IN 2-METHYLTETRAHYDROFURAN, SPCSEAL
3-羟基环己烷-1-酮
TETRA-N-BUTYLAMMONIUM HEXAFLUOROPHOSPHATE
叔丁基4-(三甲基硅基氧基)-5,6-二氢吡啶-1(2H)-甲酸酯
2,5-二甲氧基-4-[(4-硝基苯基)偶氮]苯胺
2-甲基-5-溴苯甲酰氯
3-甲基-4-甲氧基苯胺
2-(呋喃-2-基亚甲基)-6-羟基-1-苯并呋喃-3-酮