N1'-methoxycarbonylbiotin methyl ester

methyl (3aR,6S,6aS)-6-(5-methoxy-5-oxopentyl)-2-oxo-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole-3-carboxylate

Also Known As: N1'-Methoxycarbonylbiotin methyl ester|J1.431.764C|Methyl (3as,4s,6ar)-4-(5-Methoxy-5-Oxopentyl)-2-Oxohexahydro-1h-Thieno[3,4-D]imidazole-1-Carboxylate|methyl(3as,4s,6ar)-4-(5-methoxy-5-oxopentyl)-2-oxohexahydro-1h-thieno[3,4-d]imidazole-1-carboxylate|1H-Thieno(3,4-d)imidazole-4-pentanoic acid, hexahydro-1-(methoxycarbonyl)-2-oxo, methyl ester, (3aS-(3aalpha,4beta,6aalpha))-|methyl (3aR,6S,6aS)-6-(5-methoxy-5-oxopentyl)-2-oxo-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole-3-carboxylate|(3aS,3abeta,6abeta)-1-(Methoxycarbonyl)-2-oxohexahydro-1H-thieno[3,4-d]imidazole-4alpha-pentanoic acid methyl ester|1H-Thieno(3,4-d)imidazole-4-pentanoic acid,hexahydro-1-(methoxycarbonyl)-2-oxo,methyl ester,(3aS-(3aalpha,4beta,6aalpha))|1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-1-(methoxycarbonyl)-2-oxo-, methyl ester, [3aS-(3a.alpha.,4.beta.,6a.alpha.)]-|5-[(1beta,5beta)-2-(Methoxycarbonyl)-3-oxo-7-thia-2,4-diazabicyclo[3.3.0]octane-6alpha-yl]valeric acid methyl ester|methyl (3aS,4S,6aR)-4-(5-methoxy-5-oxopentyl)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazole-1-carboxylate|Y7Y

Molecular Formula	C13H20N2O5S
Molecular Weight	316.10928 g/mol
LogP	1.0
Topological Polar Surface Area	110.0 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	7
Exact Mass	316.10928
Monoisotopic Mass	316.10928
Heavy Atoms	21
Complexity	431.0

Chemical Identifiers

CAS Number	5442-31-9
SMILES	COC(=O)CCCC[C@H]1[C@@H]2[C@H](CS1)N(C(=O)N2)C(=O)OC
InChIKey	BNKOHWLXGAGMAQ-QXEWZRGKSA-N