1H-Thieno[3,4-d]imidazole-4-pentanamide,hexahydro-2-oxo-N-[6-[[1-oxo-3-(2-pyridinyldithio)propyl]amino]hexyl]-,(3aS,4S,6aR)-


Chemical Name: 1H-Thieno[3,4-d]imidazole-4-pentanamide,hexahydro-2-oxo-N-[6-[[1-oxo-3-(2-pyridinyldithio)propyl]amino]hexyl]-,(3aS,4S,6aR)-
CAS Number: 129179-83-5
Product Number: AG000YXA(AGN-PC-0PIXP3)
Synonyms:
MDL No: MFCD00078541
Molecular Formula: C24H37N5O3S3
Molecular Weight: 539.7773

Identification/Properties


Computed Properties
Molecular Weight:
539.772g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
17
Exact Mass:
539.206g/mol
Monoisotopic Mass:
539.206g/mol
Topological Polar Surface Area:
188A^2
Heavy Atom Count:
35
Formal Charge:
0
Complexity:
672
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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