AC1L6PGU

[4-[[2-[1-[2-[(4-boronophenyl)methylidene]hydrazinyl]-1-oxopropan-2-yl]sulfanylpropanoylhydrazinylidene]methyl]phenyl]boronic acid

Also Known As: [4-[(E)-[2-[1-[(2E)-2-[(4-boronophenyl)methylidene]hydraziny|Propanoic acid, 2,2'-thiobis-, bis[[(4-boronophenyl)methylene]hydrazide]|Propanoic acid, 2,2a(2)-thiobis-, bis[[(4-boronophenyl)methylene]hydrazide]|[4-[[2-[1-[2-[(4-boronophenyl)methylidene]hydrazinyl]-1-oxopropan-2-yl]sulfanylpropanoylhydrazinylidene]methyl]phenyl]boronic acid|{Sulfanediylbis[(1-oxopropane-2,1-diyl)hydrazin-2-yl-1-ylidenemethanylylidene-4,1-phenylene]}diboronic acid

Molecular Formula	C20H24B2N4O6S
Molecular Weight	470.16028 g/mol
LogP	-1.8432
Topological Polar Surface Area	189.0 Ų
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	9
Rotatable Bonds	10
Exact Mass	470.16028
Monoisotopic Mass	470.16028
Heavy Atoms	33
Complexity	627.0

Chemical Identifiers

CAS Number	6949-30-0
SMILES	B(C1=CC=C(C=C1)C=NNC(=O)C(C)SC(C)C(=O)NN=CC2=CC=C(C=C2)B(O)O)(O)O
InChIKey	ISEBYVNBSCERKA-UHFFFAOYSA-N