TOLBUTAMIDE SODIUM, STERILE

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Synonyms
Status
Molecule Category Salt-form
UNII E830VC49W5
EPA CompTox DTXSID50197090

Structure

InChI Key QKHDBRQBSNZFAK-UHFFFAOYSA-M
Smiles CCCCNC(=O)[N-]S(=O)(=O)c1ccc(C)cc1.[Na+]
InChI
InChI=1S/C12H18N2O3S.Na/c1-3-4-9-13-12(15)14-18(16,17)11-7-5-10(2)6-8-11;/h5-8H,3-4,9H2,1-2H3,(H2,13,14,15);/q;+1/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H17N2NaO3S
Molecular Weight 292.34
AlogP 1.78
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 5.0
Polar Surface Area 75.27
Molecular species ACID
Aromatic Rings 1.0
Heavy Atoms 18.0

Pharmacology

Mechanism of Action Action Reference
Sulfonylurea receptor 1, Kir6.2 blocker BLOCKER PubMed PubMed PubMed PubMed

Target Conservation

Protein: Sulfonylurea receptor 1, Kir6.2
Description: ATP-binding cassette sub-family C member 8
Organism : Homo sapiens
Q09428 ENSG00000006071
Protein: Sulfonylurea receptor 1, Kir6.2
Description: ATP-sensitive inward rectifier potassium channel 11
Organism : Homo sapiens
Q14654 ENSG00000187486

Cross References

Resources Reference
ChEMBL CHEMBL1200874
FDA SRS E830VC49W5
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