Chlorcyclamide

CAT: 0013-GTR19264761-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19264761-01Size:50 mg

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Description

Chlorcyclamide is a sulfonamide compound used in diabetes research.

CAS Number

19523-45-6

Smiles

O=C (NC1C=CCCC1) NS (=O) (=O) C2=CC=C (Cl) C=C2

Molecular Formula

C13H15ClN2O3S

Molecular Weight

314.79

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Chlorcyclamide

RN given refers to parent cpd

CAS Number	19523-45-6
PubChem CID	159871
IUPAC Name	1-(4-chlorophenyl)sulfonyl-3-cyclohex-2-en-1-ylurea
Molecular Formula	C13H15ClN2O3S
Molecular Weight	314.79
XLogP	3.1
Topological Polar Surface Area	83.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	20
Formal Charge	0
Complexity	464

SMILES

C1CC=CC(C1)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H15ClN2O3S/c14-10-6-8-12(9-7-10)20(18,19)16-13(17)15-11-4-2-1-3-5-11/h2,4,6-9,11H,1,3,5H2,(H2,15,16,17)

InChIKey

FYXGVXFKJXCRRO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 19523-45-6

CID: 159871

Formula: C13H15ClN2O3S

MW: 314.79

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	314.79
XLogP3	3.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	314.0491912
Monoisotopic Mass	314.0491912
Topological Polar Surface Area	83.7 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	464
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
HY-171845	Chlorcyclamide