2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazolidin-5-yl]ethyl phosphono hydrogen phosphate
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![2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazolidin-5-yl]ethyl phosphono hydrogen phosphate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8db13753b8f940149d86c6985a8748cd.png "2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazolidin-5-yl]ethyl phosphono hydrogen phosphate")
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazolidin-5-yl]ethyl phosphono hydrogen phosphate
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CAS No:
35728-83-7
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Formula:
C12H22N4O7P2S
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Chemical Name:
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazolidin-5-yl]ethyl phosphono hydrogen phosphate
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Synonyms:
Tetrahydrothiamine pyrophosphate; Tetrahydro-tpp; Diphosphoric acid,mono(2-(3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-4-methyl-5-thiazolidinyl)ethyl) ester; 2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazolidin-5-yl}ethyl trihydrogen diphosphate; Tetrahydrothiamine diphosphate; Tetrahydrothiamin pyrophosphate;Expand
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CAS No:
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazolidin-5-yl]ethyl phosphono hydrogen phosphate Basic Attributes
428.33800
428.06844422 g/mol
Computed Properties
Molecular Weight:428.34
XLogP3:-3.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:8
Exact Mass:428.06844422
Monoisotopic Mass:428.06844422
Topological Polar Surface Area:194
Heavy Atom Count:26
Complexity:568
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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