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111298-82-9

111298-82-9 structural image
Product Name: 7-amino-3-((5-carboxymethyl-4-methyl-1,3-thiazol-2-ylthio)methyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid
Formula: C14H15N3O5S3
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COMPUTED DESCRIPTORS

Molecular Weight 401.5 g/mol
XLogP3 -2.3
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 6
Exact Mass 401.01738411 g/mol
Monoisotopic Mass 401.01738411 g/mol
Topological Polar Surface Area 213 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 643
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes