2-(1H-benzimidazol-2-ylsulfanyl)-N'-[(Z)-(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]propanehydrazide


Chemical Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N'-[(Z)-(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]propanehydrazide
CAS Number: 330676-02-3
Product Number: AG00C0WM(AGN-PC-005XAZ)
Synonyms:
MDL No:
Molecular Formula: C17H15BrN4O2S
Molecular Weight: 419.2956

Identification/Properties


Properties
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
419.297g/mol
XLogP3:
4
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
5
Exact Mass:
418.01g/mol
Monoisotopic Mass:
418.01g/mol
Topological Polar Surface Area:
116A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
495
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
1
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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