Compound Information
Helptop of page
CID 6098385
Create Date: 2006-03-21
Suppressed Compound
Properties and Descriptors
Helptop of page
Properties
Molecular Weight 250.38228 [g/mol]
Molecular FormulaC8H7KN2OS2
H-Bond Donor1
H-Bond Acceptor3
Rotatable Bond Count0
Exact Mass249.963687
MonoIsotopic Mass249.963687
Topological Polar Surface Area105
Heavy Atom Count14
Formal Charge0
Complexity393
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Descriptors
IUPAC Name
Canonical SMILES
Isomeric SMILES
Old Version Substance Information