Dithiazanine iodideProduct ingredient for Dithiazanine
- Name
- Dithiazanine iodide
- Drug Entry
- Dithiazanine
Dithiazanine is a highly potent anthelmintic, introduced in 1959 for the treatment of strongyloid worms and whipworms. However, its use is severely limited due to its toxicity. Dithiazanine iodide was associated with eight fatal cases of severe acidosis and shock between 1961 and 1964. Dithiazanine iodide has been withdrawn from the market in countries such as France in Italy, but it may remain available in others.11,12
- Accession Number
- DBSALT001680
- Structure
Structure for Dithiazanine iodide (DBSALT001680)
- Synonyms
- Not Available
- UNII
- 8OEC3RA07X
- CAS Number
- 514-73-8
- Weight
- Average: 518.48
Monoisotopic: 518.03474 - Chemical Formula
- C23H23IN2S2
- InChI Key
- MNQDKWZEUULFPX-UHFFFAOYSA-M
- InChI
- InChI=1S/C23H23N2S2.HI/c1-3-24-18-12-8-10-14-20(18)26-22(24)16-6-5-7-17-23-25(4-2)19-13-9-11-15-21(19)27-23;/h5-17H,3-4H2,1-2H3;1H/q+1;/p-1
- IUPAC Name
- 3-ethyl-2-[5-(3-ethyl-2,3-dihydro-1,3-benzothiazol-2-ylidene)penta-1,3-dien-1-yl]-1,3-benzothiazol-3-ium iodide
- SMILES
- [I-].[H]C(C([H])=C([H])C1=[N+](CC)C2=CC=CC=C2S1)=C([H])C([H])=C1SC2=C(C=CC=C2)N1CC
- External Links
- KEGG Compound
- C18391
- ChemSpider
- 4642986
- ChEBI
- 228275
- ChEMBL
- CHEMBL421701
- Wikipedia
- Dithiazanine_iodide
- Predicted Properties
Property Value Source Water Solubility 0.00025 mg/mL ALOGPS logP 1.49 ALOGPS logP 2.52 Chemaxon logS -6.3 ALOGPS pKa (Strongest Basic) -2 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 1 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 7.12 Å2 Chemaxon Rotatable Bond Count 5 Chemaxon Refractivity 142.44 m3·mol-1 Chemaxon Polarizability 45.02 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon