Details of the Active Pharmaceutical Ingredient (API)

General Information of API (ID: D00941)
Name
Chloroxine
Synonyms    Click to Show/Hide the Synonyms of This API
chloroxine; 5,7-Dichloroquinolin-8-ol; 773-76-2; 5,7-Dichloro-8-hydroxyquinoline; 5,7-Dichloro-8-quinolinol; Capitrol; Chlorquinol; Dichloroxin; Quixalin; Chloroxyquinoline; Dichloroquinolinol; Dikhloroskin; Clofuzid; Endiaron; Quinolor; Dichlorohydroxyquinoline; Chlofucid; Quesyl; 5,7-Dichlorooxine; 5,7-Dichloroxine; 5,7-Dichloro-8-oxyquinoline; 8-QUINOLINOL, 5,7-DICHLORO-; Chlorohydroxyquinoline; Chloroxine [USAN]; 5,7-Dichlor-8-hydroxychinolin; NSC 3904; CHQ; UNII-2I8BD50I8B; MFCD00006786; 2I8BD50I8B; 5,7-Dichloro-8-hydroquinoline; CHEBI:59477; NSC3904; Chloroxine (USAN); AS-229; NCGC00095264-01; DSSTox_CID_2801; DSSTox_RID_76734; DSSTox_GSID_22801; 5,7-Dichloro-8-hydroxyquinoline, 99%; CAS-773-76-2; CCRIS 5751; Capitrol Cream Shampoo; SR-01000747474; EINECS 212-258-3; BRN 0153606; 5,7-Dichlor-8-hydroxychinolin [German]; SQ 16401; 5,7-Dichloro-8-hydroxy-quinoline; Capitrol (TN); PubChem21919; Spectrum_001434; 5,7-Dichloro-8-oxine; Spectrum2_000687; Spectrum3_001156; Spectrum4_000744; Spectrum5_001444; 8-Quinolinol,7-dichloro-; ACMC-209p9h; cid_2722; SCHEMBL3350; Oprea1_486275; REGID_for_CID_2722; BSPBio_002711; KBioGR_001068; KBioSS_001914; 5-21-03-00286 (Beilstein Handbook Reference); MLS000681736; BIDD:GT0763; DivK1c_000578; SPECTRUM1503202; SPBio_000813; ZINC1131; CHEMBL1200596; DTXSID5022801; BDBM32147; HMS501M20; KBio1_000578; KBio2_001914; KBio2_004482; KBio2_007050; KBio3_002211; NINDS_000578; HMS1923K05; HMS2092N04; HMS2609A16; HMS3259E17; HMS3655G16; HMS3712O06; Pharmakon1600-01503202; Capitrol Cream Shampoo (Salt/Mix); AMY23282; component of Capitrol Cream Shampoo; HY-B0295; NSC-3904; 5,7-Dichloro-8-quinolinol, 99%; Tox21_111494; ANW-37011; CCG-40039; NSC758398; s1839; SBB039926; STK075368; AKOS000271338; Tox21_111494_1; AC-4820; DB01243; MCULE-3987057340; NC00505; NSC-758398; IDI1_000578; UPCMLD0ENAT5752182:001; NCGC00095264-02; NCGC00095264-03; NCGC00095264-04; NCGC00095264-05; AK-89722; SMR000312779; SY016017; TG2-36-1; SBI-0051782.P002; A9795; D0412; FT-0623709; ST50160577; SW198618-2; D03472; AB00052323-08; AB00052323_09; AB00052323_10; SR-01000747474-2; SR-01000747474-3; W-104320; BRD-K17075857-001-06-9; Q12029435; F0918-0943; UNII-Z7Z4BX535U component WDFKMLRRRCGAKS-UHFFFAOYSA-N
Clinical Status
Approved
PubChem CID
2722
Formula
C9H5Cl2NO
Canonical SMILES
C1=CC2=C(C(=C(C=C2Cl)Cl)O)N=C1
InChI
1S/C9H5Cl2NO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H
InChIKey
WDFKMLRRRCGAKS-UHFFFAOYSA-N
   Click to Show/Hide the Molecular Data (Structure/Property) of This API
Structure
<iframe style="width: 300px; height: 300px;" frameborder="0" src="https://embed.molview.org/v1/?mode=balls&cid=2722"></iframe>
3D MOL 2D MOL
Physicochemical Properties Molecular Weight 214.04 Topological Polar Surface Area 33.1
XlogP 3.5 Complexity 191
Heavy Atom Count 13 Rotatable Bond Count 0
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2
Full List of Drug Formulations (DFMs) Containing This API
          Chloroxine 4% solution Click to Show/Hide the Full List of Formulation(s):          1 Formulation(s)
             Drug Formulation 1 DFM Info click to show the detail info of this DFM
                   All DIGs    Click to Show/Hide the Full List of DIGs in This DFM
Water; Cetyl Hydroxyethylcellulose; C9-11 Pareth-8; Glycerin; Fd&C Blue No 1; Anhydrous Citric Acid
                   Dosage Form Solution
                   Company Surpass Chemical.
                   DIG(s) with
                   Biological Activity
DIG Name DIG Info Representative Biological Activity of This DIG REF
Kyselina citronova DIG Info Perilipin-1 (IC50 = 3708 nM) [1]
Food blue 1 aluminum lake DIG Info Leukemia MT4 cells (IC50 = 1288.25 nM) [2]
References
1 PubChem BioAssay data set.
2 Synthesis and structure-activity relationship studies of CD4 down-modulating cyclotriazadisulfonamide (CADA) analogues. J Med Chem. 2006 Feb 23; 49(4):1291-312.

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