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Cyclopenthiazide

CAT: 0013-GTR19154996-09Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19154996-09Size:100 mg
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Description
Cyclopenthiazide is a thiazide diuretic used to treat hypertension and heart failure. It decreases the excretion of calcium ions and uric acid and increases the excretion of sodium and potassium ions. (In Vivo) :Cyclopenthiazide (0.5 mg/kg; i.p.; daily, for 3 days; female Wistar rats) increases the excretion of p-aminohippurate (PAH) .
CAS Number
742-20-1
Product Name Alternative
Cyclomethiazide | Su-8341 | SU 8341
Field of Research
Pharmacology & Drug Discovery
Purity
>98% (HPLC)
Solubility
DMSO:Soluble; Water:Insoluble
Smiles
NS (c (cc (c (NC (CC1CCCC1) N1) c2) S1 (=O) =O) c2Cl) (=O) =O
Molecular Formula
C13H18ClN3O4S2
Molecular Weight
379.88
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Cyclopenthiazide

6-chloro-3-(cyclopentylmethyl)-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide is a benzothiadiazine.

CAS Number742-20-1
PubChem CID2904
IUPAC Name6-chloro-3-(cyclopentylmethyl)-1,1-dioxo-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-7-sulfonamide
Molecular FormulaC13H18ClN3O4S2
Molecular Weight379.9
XLogP1.3
Topological Polar Surface Area135
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity637
SMILES
C1CCC(C1)CC2NC3=CC(=C(C=C3S(=O)(=O)N2)S(=O)(=O)N)Cl
InChI
InChI=1S/C13H18ClN3O4S2/c14-9-6-10-12(7-11(9)22(15,18)19)23(20,21)17-13(16-10)5-8-3-1-2-4-8/h6-8,13,16-17H,1-5H2,(H2,15,18,19)
InChIKey
BKYKPTRYDKTTJY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cyclopenthiazide
CAS: 742-20-1
CID: 2904
Formula: C13H18ClN3O4S2
MW: 379.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight379.9
XLogP31.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Exact Mass379.0427261
Monoisotopic Mass379.0427261
Topological Polar Surface Area135 Ų
Heavy Atom Count23
Formal Charge0
Complexity637
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes