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871716-62-0

871716-62-0 structural image
Product Name: 4-Thiazolecarboxylic acid, 2-[(2R)-1-[(1,1-dimethylethoxy)carbonyl]-2-pyrrolidinyl]-, ethyl ester
Formula: C15H22N2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 326.4 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 326.13002836 g/mol
Monoisotopic Mass 326.13002836 g/mol
Topological Polar Surface Area 97 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 424
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes