EdoxabanImpurity12(1R,2R,4S)
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EdoxabanImpurity12(1R,2R,4S)
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CAS No:
500572-10-1
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Formula:
C24H30ClN7O4S
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Chemical Name:
EdoxabanImpurity12(1R,2R,4S)
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Synonyms:
EthanediaMide, N1-(5-chloro-2-pyridinyl)-N2-[(1R,2R,4S)-4-[(diMethylaMino)carbonyl]-2-[[(4,5,6,7-tetrahydro-5-Methylthiazolo[5,4-c]pyridin-2-yl)carbonyl]aMino]cyclohexyl]-;N1-(5-chloropyridin-2-yl)-N2-((1R,2R,4S)-4-(diMethylcarbaMoyl)-2-(5-Methyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxaMido)cyclohexyl)oxalaMide;N1-(5-chloro-2-pyridinyl)-N2-[(1R,2R,4S)-4-[(diMethylaMino)carbonyl]-2-[[(4,5,6,7-tetrahydro-5-Methylthiazolo[5,4-c]pyridin-2-yl)carbonyl]aMino]cyclohexyl]- EthanediaMide;Edoxaban Isomer (RRS);N1-(5-chloropyridin-2-yl)-N2-((1R,2R,4S)-4-[(dimethylamino)carbonyl]-2-{[(5-methyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridin-2-yl)carbonyl]amino}cyclohexyl)ethanediamide
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CAS No:
Computed Properties
Molecular Weight:548.1
XLogP3:1.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:547.1768513
Monoisotopic Mass:547.1768513
Topological Polar Surface Area:165
Heavy Atom Count:37
Complexity:880
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
