tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole

C94H153K3N14O3S6 — CID 157277371

About tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole

tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole (PubChem CID 157277371) has the molecular formula C94H153K3N14O3S6 and a molecular weight of 1837.05 g/mol. Its IUPAC name is tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole.

Molecular Properties

• Compound Name: tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole
• PubChem CID: 157277371
• Molecular Formula: C94H153K3N14O3S6
• Molecular Weight: 1837.05 g/mol
• Exact Mass: 1834.95
• IUPAC Name: tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole
• SMILES: CC.CC.CC(C)(C)C.CC(C)(C)C.CC(C)(C)c1ccc2ccccc2n1.CC(C)(C)c1nc2ccccc2s1.CC(C)(C)c1nc2cccnc2s1.CC(C)(C)c1ncco1.CC(C)(C)c1nccs1.Cc1nc(C(C)(C)C)ns1.Cc1ncco1.Cc1nccs1.Cc1noc(C(C)(C)C)n1.Cc1nsc(C(C)(C)C)n1.[CH3-].[CH3-].[CH3-].[K+].[K+].[K+]
• InChI: InChI=1S/C13H15N.C11H13NS.C10H12N2S.C7H12N2O.2C7H12N2S.C7H11NO.C7H11NS.2C5H12.C4H5NO.C4H5NS.2C2H6.3CH3.3K/c1-13(2,3)12-9-8-10-6-4-5-7-11(10)14-12;1-11(2,3)10-12-8-6-4-5-7-9(8)13-10;1-10(2,3)9-12-7-5-4-6-11-8(7)13-9;1-5-8-6(10-9-5)7(2,3)4;1-5-8-6(9-10-5)7(2,3)4;1-5-8-6(10-9-5)7(2,3)4;2*1-7(2,3)6-8-4-5-9-6;2*1-5(2,3)4;2*1-4-5-2-3-6-4;2*1-2;;;;;;/h4-9H,1-3H3;4-7H,1-3H3;4-6H,1-3H3;3*1-4H3;2*4-5H,1-3H3;2*1-4H3;2*2-3H,1H3;2*1-2H3;3*1H3;;;/q;;;;;;;;;;;;;;3*-1;3*+1
• InChIKey: ZPUXUQXBOVVIDB-UHFFFAOYSA-N
• XLogP: 21.45
• TPSA: 219.88 Ų
• H-Bond Acceptors: 23
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1837.05
LogP ≤ 5	21.45
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole?

The IUPAC name of tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole (CID 157277371) is tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole.

What is the SMILES notation for tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole?

The canonical SMILES for tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole is CC.CC.CC(C)(C)C.CC(C)(C)C.CC(C)(C)c1ccc2ccccc2n1.CC(C)(C)c1nc2ccccc2s1.CC(C)(C)c1nc2cccnc2s1.CC(C)(C)c1ncco1.CC(C)(C)c1nccs1.Cc1nc(C(C)(C)C)ns1.Cc1ncco1.Cc1nccs1.Cc1noc(C(C)(C)C)n1.Cc1nsc(C(C)(C)C)n1.[CH3-].[CH3-].[CH3-].[K+].[K+].[K+].

What is the InChIKey of tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole?

The InChIKey is ZPUXUQXBOVVIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N.C11H13NS.C10H12N2S.C7H12N2O.2C7H12N2S.C7H11NO.C7H11NS.2C5H12.C4H5NO.C4H5NS.2C2H6.3CH3.3K/c1-13(2,3)12-9-8-10-6-4-5-7-11(10)14-12;1-11(2,3)10-12-8-6-4-5-7-9(8)13-10;1-10(2,3)9-12-7-5-4-6-11-8(7)13-9;1-5-8-6(10-9-5)7(2,3)4;1-5-8-6(9-10-5)7(2,3)4;1-5-8-6(10-9-5)7(2,3)4;2*1-7(2,3)6-8-4-5-9-6;2*1-5(2,3)4;2*1-4-5-2-3-6-4;2*1-2;;;;;;/h4-9H,1-3H3;4-7H,1-3H3;4-6H,1-3H3;3*1-4H3;2*4-5H,1-3H3;2*1-4H3;2*2-3H,1H3;2*1-2H3;3*1H3;;;/q;;;;;;;;;;;;;;3*-1;3*+1.

What are the key properties of tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole?

tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole has a molecular weight of 1837.05 g/mol, XLogP of 21.45, 0 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for tripotassium;2-tert-butyl-1,3-benzothiazole;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;5-tert-butyl-3-methyl-1,2,4-thiadiazole;2-tert-butyl-1,3-oxazole;2-tert-butylquinoline;2-tert-butyl-1,3-thiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;carbanide;bis(2,2-dimethylpropane);ethane;2-methyl-1,3-oxazole;2-methyl-1,3-thiazole is sourced from PubChem (CID 157277371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).