Carboxy Gliclazide

CAT: 0024-sc-397658Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-397658Size:10 mg

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CAS Number

38173-52-3

Chemical Information

Carboxy Gliclazide

CAS Number	38173-52-3
PubChem CID	53776869
IUPAC Name	4-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-ylcarbamoylsulfamoyl)benzoic acid
Molecular Formula	C15H19N3O5S
Molecular Weight	353.4
XLogP	-0.2
Topological Polar Surface Area	124
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Heavy Atom Count	24
Formal Charge	0
Complexity	583

SMILES

C1CC2CN(CC2C1)NC(=O)NS(=O)(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C15H19N3O5S/c19-14(20)10-4-6-13(7-5-10)24(22,23)17-15(21)16-18-8-11-2-1-3-12(11)9-18/h4-7,11-12H,1-3,8-9H2,(H,19,20)(H2,16,17,21)

InChIKey

DSNDPTBTZSQWJS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 38173-52-3

CID: 53776869

Formula: C15H19N3O5S

MW: 353.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	353.4
XLogP3	-0.2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Exact Mass	353.10454189
Monoisotopic Mass	353.10454189
Topological Polar Surface Area	124 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	583
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
Compound Is Canonicalized	Yes

Catalog	Name
sc-219497	Ortho Gliclazide (Gliclazide Impurity)
sc-211561	Gliclazide
sc-280736	Gliclazide-d4
sc-491098	Hydroxy Gliclazide
sc-491100	Hydroxy Gliclazide-d4
sc-504676	Carboxy Primaquine
sc-265508	2-Carboxy-oxazole
sc-207136	6'-Carboxy Simvastatin
sc-504654	3-Carboxy Detomidine
sc-205082	2-carboxy-Pyrimidine