methyclothiazide   Click here for help

GtoPdb Ligand ID: 7235

Synonyms: Aquatensen® | Enduron®
Approved drug
methyclothiazide is an approved drug (FDA (1960))
Compound class: Synthetic organic
Comment: Methyclothiazide is a diuretic.
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 126.33
Molecular weight 358.96
XLogP 0.57
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES ClCC1Nc2cc(Cl)c(cc2S(=O)(=O)N1C)S(=O)(=O)N
Isomeric SMILES ClCC1Nc2cc(Cl)c(cc2S(=O)(=O)N1C)S(=O)(=O)N
InChI InChI=1S/C9H11Cl2N3O4S2/c1-14-9(4-10)13-6-2-5(11)7(19(12,15)16)3-8(6)20(14,17)18/h2-3,9,13H,4H2,1H3,(H2,12,15,16)
InChI Key CESYKOGBSMNBPD-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1960))
IUPAC Name Click here for help
6-chloro-3-(chloromethyl)-2-methyl-1,1-dioxo-3,4-dihydro-1$l^{6},2,4-benzothiadiazine-7-sulfonamide
International Nonproprietary Names Click here for help
INN number INN
1050 methyclothiazide
Synonyms Click here for help
Aquatensen® | Enduron®
Database Links Click here for help
CAS Registry No. 135-07-9
ChEMBL Ligand CHEMBL1577
DrugBank Ligand DB00232
DrugCentral Ligand 1759
GtoPdb PubChem SID 178103809
PubChem CID 4121
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Wikipedia Methyclothiazide