Tetrahydrothiamine pyrophosphate

2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazolidin-5-yl]ethyl phosphono hydrogen phosphate

Also Known As: Tetrahydro-tpp|Tetrahydrothiamine diphosphate|Tetrahydrothiamine pyrophosphate|Tetrahydrothiamin pyrophosphate|AC1L1XDI|RefChem:188714|J812.418C|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}ethoxy)(hydroxy)phosphoryl]oxy}phosphonic acid|2-{3-[(6-Imino-2-methyl-1,6-dihydropyrimidin-5-yl)methyl]-4-methyl-1,3-thiazolidin-5-yl}ethyl trihydrogen diphosphate|3-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-5-[2-[[(phosphonooxy)phosphonyl]oxy]ethyl]-4-methylthiazolidine|Diphosphoric acid, mono(2-(3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-4-methyl-5-thiazolidinyl)ethyl) ester

Molecular Formula	C12H22N4O7P2S
Molecular Weight	428.06845 g/mol
LogP	1.25
Topological Polar Surface Area	168.33 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	9
Rotatable Bonds	8
Exact Mass	428.06845
Heavy Atoms	26
Complexity	733.5

Chemical Identifiers

CAS Number	35728-83-7
SMILES	CC1C(SCN1CC2=CN=C(N=C2N)C)CCOP(=O)(O)OP(=O)(O)O