81785-28-6
Product Name:
5-(2-Hydroxy-3-(2-cyanophenoxy)-propylamino)-5-desoxy-1,4:3,6-dianhydr o-L-idit-2-nitrat HCl
Formula:
C16H19N3O7.ClH
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COMPUTED DESCRIPTORS
Molecular Weight | 401.8 g/mol |
---|---|
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 9 |
Rotatable Bond Count | 7 |
Exact Mass | 401.0989777 g/mol |
Monoisotopic Mass | 401.0989777 g/mol |
Topological Polar Surface Area | 139 Ų |
Heavy Atom Count | 27 |
Formal Charge | 0 |
Complexity | 534 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 4 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 2 |
Compound Is Canonicalized | Yes |