2-(1H-imidazol-5-yl)ethyl carbamimidothioate;dihydrobromide


Chemical Name: 2-(1H-imidazol-5-yl)ethyl carbamimidothioate;dihydrobromide
CAS Number: 32385-58-3
Product Number: AG00C5P4(AGN-PC-00IQSX)
Synonyms:
MDL No: MFCD00153816
Molecular Formula: C6H12Br2N4S
Molecular Weight: 332.0593

Identification/Properties


Computed Properties
Molecular Weight:
332.058g/mol
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
331.913g/mol
Monoisotopic Mass:
329.915g/mol
Topological Polar Surface Area:
104A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
139
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
3
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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