S-[3-carbamoylsulfanyl-2-(dimethylamino)propyl] carbamothioate;hydrochloride


Chemical Name: S-[3-carbamoylsulfanyl-2-(dimethylamino)propyl] carbamothioate;hydrochloride
CAS Number: 22042-59-7
Product Number: AG0070ST(AGN-PC-0JKLN2)
Synonyms:
MDL No:
Molecular Formula: C7H16ClN3O2S2
Molecular Weight: 273.8038

Identification/Properties


Computed Properties
Molecular Weight:
273.794g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
7
Exact Mass:
273.037g/mol
Monoisotopic Mass:
273.037g/mol
Topological Polar Surface Area:
140A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
193
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:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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