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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 Weight: 494.0130000000003 g/mol

Names and Synonyms:

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

Identifiers:

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

Spectral Data

NMR, IR, and Mass spectral data

1H NMR
13C NMR
Predicting NMR spectra...
10 ppm 9 8 7 6 5 4 3 2 1 0 ppm
Shift (ppm) Multiplicity Integration Assignment
200 ppm 180 160 140 120 100 80 60 40 20 0 ppm
Shift (ppm) DEPT Assignment

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

External Resources

All Properties

Comprehensive physical and chemical properties

Molecular

Property Value Source
Molecular Weight 494.0130000000003 g/mol RDKit

Exact

Property Value Source
Exact Molecular Weight 493.14381967599996 g/mol RDKit

Heavy

Property Value Source
Heavy Atom Count 33 count RDKit

Hydrogen

Property Value Source
Hydrogen Bond Acceptors 5 count RDKit
Hydrogen Bond Donors 3 count RDKit

Rotatable

Property Value Source
Rotatable Bonds 8 count RDKit

Aromatic

Property Value Source
Aromatic Ring Count 2 count RDKit

Topological

Property Value Source
Topological Polar Surface Area 120.58000000000001 Ų RDKit

Physical Properties

Property Value Source
LogP 4.420900000000003 RDKit
cas-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) None Legacy Database
cas-inchi-key InChIKey=ZNNLBTZKUZBEKO-UHFFFAOYSA-N None Legacy Database
cas-melting-point 169 °C None Legacy Database
cas-name Glibenclamide None Legacy Database
molecular_mass 494.01 g/mol Legacy Database
cas-canonical-smile O=C(NC1CCCCC1)NS(=O)(=O)C2=CC=C(C=C2)CCNC(=O)C3=CC(Cl)=CC=C3OC None Legacy Database

Molar

Property Value Source
Molar Refractivity 129.44110000000003 RDKit

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