benzyl 5-[(3aS,4S,6aR)-1,3-dibenzyl-2-oxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-4-yl]pentanoate
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![benzyl 5-[(3aS,4S,6aR)-1,3-dibenzyl-2-oxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-4-yl]pentanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/94014a2ea4cd4a88a5137ccba8f040a5.png "benzyl 5-[(3aS,4S,6aR)-1,3-dibenzyl-2-oxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-4-yl]pentanoate")
benzyl 5-[(3aS,4S,6aR)-1,3-dibenzyl-2-oxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-4-yl]pentanoate
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CAS No:
179532-60-6
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Formula:
C31H34N2O3S
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Chemical Name:
benzyl 5-[(3aS,4S,6aR)-1,3-dibenzyl-2-oxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-4-yl]pentanoate
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Synonyms:
benzyl 5-[(3aS,4S,6aR)-1,3-dibenzyl-2-oxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-4-yl]pentanoate;Biotin deriv.;179532-60-6;(3abeta,6abeta)-1,3-Dibenzyl-2-oxohexahydro-1H-thieno[3,4-d]imidazole-4alpha-pentanoic acid benzyl ester;5-((3aR,6S,6aS)-1,3-Dibenzyl-2-oxo-hexahydro-thieno[3,4-d]imidazol-6-yl)-pentanoic acid benzyl ester;Benzyl 5-((3aS,4S,6aR)-1,3-dibenzyl-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoate
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CAS No:
benzyl 5-[(3aS,4S,6aR)-1,3-dibenzyl-2-oxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-4-yl]pentanoate Basic Attributes
514.7 g/mol
514.22901412 g/mol
Computed Properties
Molecular Weight:514.7
XLogP3:5.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:12
Exact Mass:514.22901412
Monoisotopic Mass:514.22901412
Topological Polar Surface Area:75.2
Heavy Atom Count:37
Complexity:730
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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