5-[(3aS,4R,6aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[5-(1,3-dioxolan-2-yl)pentyl]pentanamide
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![5-[(3aS,4R,6aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[5-(1,3-dioxolan-2-yl)pentyl]pentanamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ba1fd58327ee4569bd833bcd3d923325.png "5-[(3aS,4R,6aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[5-(1,3-dioxolan-2-yl)pentyl]pentanamide")
5-[(3aS,4R,6aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[5-(1,3-dioxolan-2-yl)pentyl]pentanamide
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CAS No:
124884-03-3
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Formula:
C18H31N3O4S
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Chemical Name:
5-[(3aS,4R,6aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[5-(1,3-dioxolan-2-yl)pentyl]pentanamide
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Synonyms:
N-(6-(ethylenedioxy)hexyl)biotinamide;N-EDHBA;N-Edhba;124884-03-3;N-(6-(Ethylenedioxy)hexyl)biotinamide;DTXSID00924954;N-(5-(1,3-Dioxolan-2-yl)pentyl)hexahydro-2-oxo-1H-thieno(3,4-d)imidazole-4-pentanamide (3aS-(3alpha,4beta,6aalpha))-;1H-Thieno(3,4-d)imidazole-4-pentanamide, N-(5-(1,3-dioxolan-2-yl)pentyl)hexahydro-2-oxo-, (3aS-(3alpha,4beta,6aalpha))-;N-[5-(1,3-Dioxolan-2-yl)pentyl]-5-(2-hydroxy-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-6-yl)pentanimidic acid
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CAS No:
5-[(3aS,4R,6aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[5-(1,3-dioxolan-2-yl)pentyl]pentanamide Basic Attributes
385.5 g/mol
385.20352765 g/mol
Computed Properties
Molecular Weight:385.5
XLogP3:1.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:11
Exact Mass:385.20352765
Monoisotopic Mass:385.20352765
Topological Polar Surface Area:114
Heavy Atom Count:26
Complexity:473
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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