cyclothiazide   Click here for help

GtoPdb Ligand ID: 4167

Synonyms: Anhydron® | Aquirel®
Approved drug
cyclothiazide is an approved drug
Compound class: Synthetic organic
Comment: Cyclothiazide functions primarily as an inhibior of the sodium-chloride symporter (SLC12A3) in distal convoluted tubules.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 2
Topological polar surface area 135.12
Molecular weight 389.03
XLogP 1.59
No. Lipinski's rules broken 0
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Canonical SMILES Clc1cc2NC(NS(=O)(=O)c2cc1S(=O)(=O)N)C1CC2CC1C=C2
Isomeric SMILES Clc1cc2NC(NS(=O)(=O)c2cc1S(=O)(=O)N)C1CC2CC1C=C2
InChI InChI=1S/C14H16ClN3O4S2/c15-10-5-11-13(6-12(10)23(16,19)20)24(21,22)18-14(17-11)9-4-7-1-2-8(9)3-7/h1-2,5-9,14,17-18H,3-4H2,(H2,16,19,20)
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
1138 cyclothiazide
Synonyms Click here for help
Anhydron® | Aquirel®
Database Links Click here for help
CAS Registry No. 2259-96-3 (source: SciFinder)
ChEMBL Ligand CHEMBL61593
DrugBank Ligand DB00606
DrugCentral Ligand 761
GtoPdb PubChem SID 178100987
PubChem CID 2910
Search Google for chemical match using the InChIKey BOCUKUHCLICSIY-UHFFFAOYSA-N
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UniChem Compound Search for chemical match using the InChIKey BOCUKUHCLICSIY-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey BOCUKUHCLICSIY-UHFFFAOYSA-N
Wikipedia Cyclothiazide

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Cyclothiazide (links to external site)
Cat. No. 0713