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Molecule

Glibenclamide

CAS: 10238-21-8 · C23H28ClN3O5S

2D Structure

3D Structure

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Basic Information

CAS Registry Number
10238-21-8
Molecular Formula
C23H28ClN3O5S
Molecular Mass
494.01 g/mol

Identifiers

CAS Registry Number

10238-21-8

SMILES

COc1ccc(Cl)cc1C(O)=NCCc1ccc(S(=O)(=O)NC(O)=NC2CCCCC2)cc1

InChI Key

ZNNLBTZKUZBEKO-UHFFFAOYSA-N

InChI

InChI=1S/C23H28ClN3O5S/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)

Names and Synonyms

  • Glibenclamide Common Name
  • Tiabet Synonym
  • Orabetic Synonym
  • Glitisol Synonym
  • Prodiabet Synonym
  • Glukovital Synonym
  • Glynase Synonym
  • Melix Synonym
  • Glucal Synonym
  • Diaben Synonym
  • Norboral Synonym
  • Semi-Daonil Synonym
  • Wuglucon Synonym
  • Gl Synonym
  • Dia-basan Synonym
  • Glucoremed Synonym
  • Benzamide, 5-chloro-N-[2-[4-[[[(cyclohexylamino)carbonyl]amino]sulfonyl]phenyl]ethyl]-2-methoxy- Synonym
  • Urea, 1-[[p-[2-(5-chloro-o-anisamido)ethyl]phenyl]sulfonyl]-3-cyclohexyl- Synonym
  • 5-Chloro-N-[2-[4-[[[(cyclohexylamino)carbonyl]amino]sulfonyl]phenyl]ethyl]-2-methoxybenzamide Synonym
  • 1-[4-[2-(5-Chloro-2-methoxybenzamido)ethyl]phenylsulfonyl]-3-cyclohexylurea Synonym
  • Glibenclamide Synonym
  • Glybenzcyclamide Synonym
  • Glyburide Synonym
  • HB 419 Synonym
  • N-[4-(β-(2-Methoxy-5-chlorobenzamido)ethyl)benzosulfonyl]-N′-cyclohexylurea Synonym
  • 1-[[-p-[2-(5-Chloro-o-anisamido)ethyl]phenyl]sulfonyl]-3-cyclohexylurea Synonym
  • U 26452 Synonym
  • N-4-[2-(5-Chloro-2-methoxybenzamido)ethyl]phenylsulfonyl-N′-cyclohexylurea Synonym
  • HD 419 Synonym
  • N-[4-[β-(2-Methoxy-5-chlorobenzamido)ethyl]benzenesulfonyl]-N′-cyclohexylurea Synonym
  • Maninil Synonym
  • Euglucon 5 Synonym
  • UR 606 Synonym
  • 1-[p-2-(5-Chloro-o-anisamido)ethylphenylsulfonyl]-3-cyclohexylurea Synonym
  • Daonil Synonym
  • Euglucon Synonym
  • Gilemal Synonym
  • Diabeta Synonym
  • Euglucan Synonym
  • Euglykon Synonym
  • Semi-Euglucon N Synonym
  • Semi-Euglucon Synonym
  • Daonil N Synonym
  • Glycolande N Synonym
  • Betanase Synonym
  • Betanaz Synonym
  • Micronase Synonym
  • Med-Glionil Synonym
  • Humedia Synonym
  • Miglucan Synonym
  • Betanese 5 Synonym
  • Glibens Synonym
  • Glucohexal Synonym
  • Debtan Synonym
  • Antibet Synonym
  • Dibelet Synonym
  • Glimel Synonym
  • Cytagon Synonym
  • Glibet Synonym
  • Azuglucon Synonym
  • Glycomin Synonym
  • Glibetic Synonym
  • Glucolon Synonym
  • Glisulin Synonym
  • Glicem Synonym
  • Glyben Synonym
  • GBN 5 Synonym
  • Bastiverit Synonym
  • Glibesyn Synonym
  • Sugril Synonym
  • Suraben Synonym
  • Gliben Synonym
  • Glucoven Synonym
  • Libanil Synonym
  • Glucomid Synonym
  • Gliban Synonym
  • Glibenil Synonym
  • Hemi-Daonil Synonym
  • Calabren Synonym
  • Benclamin Synonym
  • Glamide Synonym
  • Glibil Synonym
  • Pira Synonym
  • Gliboral Synonym
  • Glucobene Synonym
  • Renabetic Synonym
  • Apo-Glibenclamide Synonym
  • Glimide Synonym
  • Glidiabet Synonym
  • Gluben Synonym
  • Yuglucon Synonym
  • Glycolande Synonym
  • Duraglucon Synonym
  • Gliben-Puren N Synonym
  • Gluco-Tabinen Synonym
  • Abbenclamide Synonym
  • Adiab Synonym
  • Diabiphage Synonym
  • Glubate Synonym
  • Glimidstada Synonym
  • Glibomet Synonym
  • RP 1127 Synonym
  • Glustat Synonym
  • Glyform Synonym
  • Gluvans Synonym
  • Glicuformine Synonym
  • Glymet Synonym
  • Glyburine Synonym
  • 5-Chloro-N-(2-(4-(N-(cyclohexylcarbamoyl)sulfamoyl)phenyl)ethyl)-2-methoxybenzamide Synonym
  • Diazet Synonym
  • Amglidia Synonym

All Properties

Comprehensive physical and chemical properties

Property Value Source
Molecular Mass 494.01 g/mol CAS Common Chemistry
494.0130000000003 g/mol RDKit
494.013 g/mol RDKit
494.003 g/mol chempirical lib
Canonical SMILES O=C(NC1CCCCC1)NS(=O)(=O)C2=CC=C(C=C2)CCNC(=O)C3=CC(Cl)=CC=C3OC CAS Common Chemistry
InChI InChI=1S/C23H28ClN3O5S/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) CAS Common Chemistry
InChI Key InChIKey=ZNNLBTZKUZBEKO-UHFFFAOYSA-N CAS Common Chemistry
Melting Point 169 °C CAS Common Chemistry
Name Glibenclamide CAS Common Chemistry
Heavy Atom Count 33 RDKit
Hydrogen Bond Acceptors 5 RDKit
Hydrogen Bond Donors 3 RDKit
Rotatable Bonds 8 RDKit
Aromatic Ring Count 2 RDKit
Topological Polar Surface Area 120.58000000000001 Ų RDKit
120.58 Ų RDKit
LogP 4.420900000000003 RDKit
4.4209 RDKit
4.38 chempirical lib
Molar Refractivity 129.44110000000003 cm³/mol RDKit
Ring Count 3 RDKit
Formal Charge 0 RDKit
Fraction Csp3 0.3913 RDKit
0.39 chempirical lib
Exact Mass 493.14381967599996 g/mol RDKit

Spectral Data

NMR, IR, and Mass spectral data

Predicting NMR spectra...
10 ppm 9 8 7 6 5 4 3 2 1 0 ppm
Shift (ppm) Multiplicity Integration Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

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MW = 494.01 g/mol. Edit any field — others recompute live.

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