21547-71-7
Product Name:
2-(1 H-BENZOIMIDAZOL-2-YLSULFANYL)-BUTYRIC ACID
Formula:
C11H12N2O2S
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COMPUTED DESCRIPTORS
Molecular Weight | 236.29 g/mol |
---|---|
XLogP3 | 2.9 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 4 |
Exact Mass | 236.06194880 g/mol |
Monoisotopic Mass | 236.06194880 g/mol |
Topological Polar Surface Area | 91.3 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 262 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |