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Glibenclamide potassium salt

CAT: 0926-YAA04714Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0926-YAA04714Size:500 mg
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CAS Number
23047-14-5
Smiles
COC1=C (C=C (C=C1) Cl) C (=NCCC2=CC=C (C=C2) S (=O) (=O) NC (=NC3CCCCC3) [O-]) [O-].[K+].[K+]
Molecular Formula
C23H26ClK2N3O5S
Molecular Weight
570.2 g/mol
Controlled
No

Chemical Information

Glibenclamide potassium salt
CAS Number23047-14-5
PubChem CID91826496
IUPAC Namedipotassium;5-chloro-N-[2-[4-[(N-cyclohexyl-C-oxidocarbonimidoyl)sulfamoyl]phenyl]ethyl]-2-methoxybenzenecarboximidate
Molecular FormulaC23H26ClK2N3O5S
Molecular Weight570.2
Topological Polar Surface Area135
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Heavy Atom Count35
Formal Charge0
Complexity771
SMILES
COC1=C(C=C(C=C1)Cl)C(=NCCC2=CC=C(C=C2)S(=O)(=O)NC(=NC3CCCCC3)[O-])[O-].[K+].[K+]
InChI
InChI=1S/C23H28ClN3O5S.2K/c1-32-21-12-9-17(24)15-20(21)22(28)25-14-13-16-7-10-19(11-8-16)33(30,31)27-23(29)26-18-5-3-2-4-6-18;;/h7-12,15,18H,2-6,13-14H2,1H3,(H,25,28)(H2,26,27,29);;/q;2*+1/p-2
InChIKey
AYVRWNXZNHAWAH-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Glibenclamide potassium salt
CAS: 23047-14-5
CID: 91826496
Formula: C23H26ClK2N3O5S
MW: 570.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight570.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Exact Mass569.0555828
Monoisotopic Mass569.0555828
Topological Polar Surface Area135 Ų
Heavy Atom Count35
Formal Charge0
Complexity771
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes