Related Searches: Gliclazide

Gliclazide(CAS No. 21187-98-4)

Gliclazide C15H21N3O3S (cas 21187-98-4) Molecular Structure

21187-98-4 Structure

Identification and Related Records

【Name】
Gliclazide
【Iupac name】
1-(3,3a,4,5,6,
6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-(4-methylphenyl)sulfonylurea
【CAS Registry number】
21187-98-4
【Synonyms】
Urea,1-(hexahydrocyclopenta[c]pyrrol-2(1H)-yl)-3-(p-tolylsulfonyl)- (8CI)
Cyclopenta[c]pyrrole, benzenesulfonamide deriv.
1-(Hexahydrocyclopenta[c]pyrrol-2(1H)-yl)-3-(p-tolylsulfonyl)urea
Diabezidum
Diabyl
Diamicron
Diaprel
Glimicron
Glinormax
Glyzide
N-(4-Methylbenzenesulfonyl)-N'-[3-azabicyclo(3,3,0)oct-3-yl]urea
S1702
S 852
SE 1702
Benzenesulfonamide,N-[[(hexahydrocyclopenta[c]pyrrol-2(1H)-yl)amino]carbonyl]-4-methyl-
【EINECS(EC#)】
244-260-5
【Molecular Formula】
C15H21N3O3S (Products with the same molecular formula)
【Molecular Weight】
323.41054
【Inchi】
InChI=1S/C15H21N3O3S/c1-11-5-7-14(8-6-11)22(20,21)17-15(19)16-18-9-12-3-2-4-13(12)10-18/h5-8,12-13H,2-4,9-10H2,1H3,(H2,16,17,19)
【InChIKey】
BOVGTQGAOIONJV-UHFFFAOYSA-N
【Canonical SMILES】
CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NN2CC3CCCC3C2
【MOL File】
21187-98-4.mol

Chemical and Physical Properties

【Appearance】
white powder
【Density】
1.35 g/cm3
【Melting Point】
163-169℃
【Refractive Index】
1.623
【Water】
methylene chloride: soluble
【Solubilities】
methylene chloride: soluble
【Color/Form】
white
【Stability】
Stable at normal temperatures and pressures. Heat.
【Storage temp】
Keep tightly closed.
【Computed Properties】
Molecular Weight:323.41054 [g/mol]
Molecular Formula:C15H21N3O3S
XLogP3:1.5
H-Bond Donor:2
H-Bond Acceptor:4
Rotatable Bond Count:3
Tautomer Count:3
Exact Mass:323.130362
MonoIsotopic Mass:323.130362
Topological Polar Surface Area:86.9
Heavy Atom Count:22
Formal Charge:0
Complexity:497
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:3
Feature 3D Donor Count:2
Feature 3D Ring Count:3
Effective Rotor Count:6.2
Conformer Sampling RMSD:0.8
CID Conformer Count:89

Safety and Handling

【Hazard Codes】
Xn,Xi
【Risk Statements】
R21
【Safety Statements 】
25-26-36/37-53
【Safety】
Hazard Codes:HarmfulXn,IrritantXi
Risk Statements:21-36/38-46-62-63
R21:Harmful in contact with skin?
R36/38:Irritating to eyes and skin
R46:May cause heritable genetic damage?
R62:Possible risk of impaired fertility?
R63:Possible risk of harm to the unborn child?
Safety Statements:25-26-36/37-53
S25:Avoid contact with eyes?
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
S36/37:Wear suitable protective clothing and gloves???
S53:Avoid exposure - obtain special instruction before use
WGK Germany:2
RTECS:YT4500000
【Specification】
?Gliclazide (CAS NO.21187-98-4), its Synonyms are 1-(3-Azabicyclo(3.3.0)oct-3-yl)-3-(p-tolylsulfonyl)urea ; 1-(Hexahydrocyclopenta(c)pyrrol-2(1H)-yl)-3-(p-tolylsulfonyl)urea ; Benzenesulfonamide, N-(((hexahydrocyclopenta(c)pyrrol-2(1H)-yl)amino)carbonyl)-4-methyl- ; Diamicron ; Glimicron ; N-(4-Methylbenzenesulfonyl)-N'-(3-azabicyclo(3.3.0)oct-3-yl)urea ; Nordialex .

Use and Manufacturing

【Usage】

A sulfonylurea hypoglycemic agent. Used as an antidiabetic

Biomedical Effects and Toxicity

【Pharmacological Action】
- Substances which lower blood glucose levels.
【Therapeutic Uses】
A sulfonylurea hypoglycemic agent. Used as an antidiabetic

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