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Glyburide potassium

CAT: 0926-CCA16936-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0926-CCA16936-01Size:5 g
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CAS Number
52169-36-5
Smiles
COC1=C (C=C (C=C1) Cl) C (=O) NCCC2=CC=C (C=C2) S (=O) (=O) NC (=O) NC3CCCCC3.[K]
Molecular Formula
C23H28ClKN3O5S
Molecular Weight
533.1 g/mol
Controlled
No

Chemical Information

Glyburide (potassium salt)

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CAS Number52169-36-5
PubChem CID131880175
Molecular FormulaC23H28ClKN3O5S
Molecular Weight533.1
Topological Polar Surface Area122
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count34
Formal Charge0
Complexity746
SMILES
COC1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3.[K]
InChI
InChI=1S/C23H28ClN3O5S.K/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);
InChIKey
WUVNANLGKVVVAV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Glyburide (potassium salt)
CAS: 52169-36-5
CID: 131880175
Formula: C23H28ClKN3O5S
MW: 533.1
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight533.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass532.1075264
Monoisotopic Mass532.1075264
Topological Polar Surface Area122 Ų
Heavy Atom Count34
Formal Charge0
Complexity746
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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