1-[(2S)-2-[(7-chloro-1-benzothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid


Chemical Name: 1-[(2S)-2-[(7-chloro-1-benzothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid
CAS Number: 99592-39-9
Product Number: AG00IKBD(AGN-PC-0H2584)
Synonyms:
MDL No: MFCD00918063
Molecular Formula: C20H16Cl3N3O4S
Molecular Weight: 500.7827

Identification/Properties


Computed Properties
Molecular Weight:
500.775g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
6
Exact Mass:
498.993g/mol
Monoisotopic Mass:
498.993g/mol
Topological Polar Surface Area:
121A^2
Heavy Atom Count:
31
Formal Charge:
0
Complexity:
513
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:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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