Basic information
- CAS
478482-75-6- Standard SMILES
Ic1cccc(CSc2nnc(-c3ccncc3)o2)c1- InChIKey
ZRHRPGSSSVYBRG-UHFFFAOYSA-N- Molecular formula
- C14H10IN3OS
- Average molar mass
- 395.22 g/mol
- Monoisotopic mass
- 394.95893
Overview
2-[(3-iodophenyl)methylthio]-5-pyridin-4-yl-1,3,4-oxadiazole is an aryl sulfide.
Names & identifiers
- Preferred name
- GSK-3 Inhibitor II
- IUPAC
- 2-[(3-iodophenyl)methylsulfanyl]-5-pyridin-4-yl-1,3,4-oxadiazole
- English name
- 2-THIO(3-IODOBENZYL)-5-(1-PYRIDYL)-[1,3,4]-OXADIAZOLE
- Molecular formula
- C14H10IN3OS
- Molecular weight
- 395.22
Names & synonyms
478482-75-6GSK-3 Inhibitor IIGSK-3beta Inhibitor IIGSK3beta Inhibitor IIGSK3|A Inhibitor II2-((3-Iodobenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole2-[(3-iodophenyl)methylsulfanyl]-5-pyridin-4-yl-1,3,4-oxadiazole2-Thio(3-iodobenzyl)-5-(1-pyridyl)-[1,3,4]-oxadiazole4-(5-{[(3-iodophenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)pyridine2-[(3-iodophenyl)methylsulfanyl]-5-(4-pyridyl)-1,3,4-oxadiazolePyridine, 4-[5-[[(3-iodophenyl)methyl]thio]-1,3,4-oxadiazol-2-yl]-MFCD04974171
Show more names
TIBPOGSK3β Inhibitor IIGSK3.beta. Inhibitor IIGSK3β inhibitor II, 10 mM in DMSOGLYCOGEN SYNTHASE KINASE-3 INHIBITOR IIGSK-3β Inhibitor II - CAS 478482-75-6 - Calbiochem4-[5-[[(3-Iodophenyl)methyl]thio]-1,3,4-oxadiazol-2-yl]pyridine
GSK-3beta Inhibitor II?K00026C14H10IN3OSBDBM8552CHEMBL288064GTPL5978orb1704915SCHEMBL5022122
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 77.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 304
Physicochemical properties
- Boiling point
- 532.6 · 532.6±60.0 °C(Predicted)
- Density
- 1.79 · 1.79±0.1 g/cm3(Predicted)
- storage temp.
- -20 C · -20C
- solubility
- 3 mg/ml · ≤3mg/ml in DMSO;10mg/ml in dimethyl formamide
- form
- Yellow solid
- pka
- 0.97 · 0.97±0.10(Predicted)
- color
- White to off-white
Chemistry & industry
Applications
UsesGSK3β inhibitor II is an inhibitor of GSK3β. GSK3β inhibitor II can be used for research of Alzheimer’s disease (AD)[1].
Suppliers23 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Aladdin Scientific[email protected]
南通菡芳生物科技有限公司[email protected] 18017580634 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
銳迪國際科技有限公司18024082417 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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