Timoprazole
Timoprazole structure
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Common Name | Timoprazole | ||
|---|---|---|---|---|
| CAS Number | 57237-97-5 | Molecular Weight | 257.31100 | |
| Density | 1.45g/cm3 | Boiling Point | 540.3ºC at 760mmHg | |
| Molecular Formula | C13H11N3OS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 280.6ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.45g/cm3 |
|---|---|
| Boiling Point | 540.3ºC at 760mmHg |
| Molecular Formula | C13H11N3OS |
| Molecular Weight | 257.31100 |
| Flash Point | 280.6ºC |
| Exact Mass | 257.06200 |
| PSA | 77.85000 |
| LogP | 3.13140 |
| Index of Refraction | 1.751 |
| InChIKey | HBDKFZNDMVLSHM-UHFFFAOYSA-N |
| SMILES | O=S(Cc1ccccn1)c1nc2ccccc2[nH]1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~83%
Timoprazole CAS#:57237-97-5 |
| Literature: Quelever, Gilles; Sturtz, Georges Bulletin de la Societe Chimique de France, 1997 , vol. 134, # 8-9 p. 817 - 822 |
|
~40%
Timoprazole CAS#:57237-97-5 |
| Literature: Beattie; Crossley; Dickinson; Dover European Journal of Medicinal Chemistry, 1983 , vol. 18, # 3 p. 277 - 285 |
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~%
Timoprazole CAS#:57237-97-5
Learn More
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| Literature: Sih, John C.; Im, Wha Bin; Robert, Andre; Graber, David R.; Blakeman, David P. Journal of Medicinal Chemistry, 1991 , vol. 34, # 3 p. 1049 - 1062 |
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~%
Timoprazole CAS#:57237-97-5 |
| Literature: Quelever, Gilles; Sturtz, Georges Bulletin de la Societe Chimique de France, 1997 , vol. 134, # 8-9 p. 817 - 822 |
|
~%
Timoprazole CAS#:57237-97-5 |
| Literature: Quelever, Gilles; Sturtz, Georges Bulletin de la Societe Chimique de France, 1997 , vol. 134, # 8-9 p. 817 - 822 |
![2-{[(pyridin-2-yl)methyl]thio}-1H-benzimidazole structure](https://image.chemsrc.com/caspic/446/23593-22-8.png)
![2-((pyridin-2-ylmethyl)thio)-1H-benzo[d]imidazole hydrochloride structure](https://image.chemsrc.com/caspic/408/23593-23-9.png)
![2-[(2-pyridinylmethyl)thio]-1-(morpholinylmethyl)benzimidazole structure](https://image.chemsrc.com/caspic/106/132750-25-5.png)
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Activity was evaluated by measuring the inhibition of isolated hog H+/K+ ATPase
Source: ChEMBL
Target: Potassium-transporting ATPase subunit beta
External Id: CHEMBL687662
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Name: Inhibition of isolated rat H+/K+ ATPase.
Source: ChEMBL
Target: Potassium-transporting ATPase subunit beta
External Id: CHEMBL690658
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Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: ULK1_INH_LUMI_1536_1X%INH PRUN
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Name: Inhibitory activity when administered intravenously in histamine-stimulated gastric f...
Source: ChEMBL
Target: Canis lupus familiaris
External Id: CHEMBL667789
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Name: Antisecretory effect in isolated rabbit gastric glands as measured by aminopyrine upt...
Source: ChEMBL
Target: Oryctolagus cuniculus
External Id: CHEMBL768177
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Name: ASTRAZENECA: Most acidic pKa value (pKa A1) determined by absorption and potentiometr...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3301375
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Name: In vitro inhibitory activity against H+/K+ ATPase prepared from canine fundic mucosa
Source: ChEMBL
Target: Potassium-transporting ATPase alpha chain 1
External Id: CHEMBL689040
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Name: Inhibition of acid secretion was determined by the compound administered subcutaneous...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL779695
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Name: ASTRAZENECA: Most basic pKa value (pKa B1) determined by absorption and potentiometri...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3301362
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Timoprazol |
| Timoprazole [INN] |
| 2-[[(2-pyridinyl)methyl]sulfinyl]benzimidazole |
| Timoprazolum |
| 2-[(2-pyridyl)methylsulphinyl]benzimidazole |
| Timoprazolum [INN-Latin] |
| Timoprazole |
| 2-(pyridin-2-ylmethylsulfinyl)benzimidazole |
| 2-[(pyridin-2-ylmethyl)sulfinyl]-1h-benzimidazole |
| Timoprazol [INN-Spanish] |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole? |
| A: InChIKey of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole is HBDKFZNDMVLSHM-UHFFFAOYSA-N. |
| Q: What English synonyms does 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole have? |
| A: English synonyms of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole: Timoprazol, Timoprazole [INN], 2-[[(2-pyridinyl)methyl]sulfinyl]benzimidazole, Timoprazolum, 2-[(2-pyridyl)methylsulphinyl]benzimidazole, Timoprazolum [INN-Latin], Timoprazole, 2-(pyridin-2-ylmethylsulfinyl)benzimidazole, 2-[(pyridin-2-ylmethyl)sulfinyl]-1h-benzimidazole, Timoprazol [INN-Spanish]. |
| Q: What is the SMILES notation of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole? |
| A: SMILES notation of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole is O=S(Cc1ccccn1)c1nc2ccccc2[nH]1. |
| Q: What is the LogP of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole? |
| A: LogP of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole is 3.13140. |
| Q: What is the boiling point of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole? |
| A: Boiling point of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole is 540.3ºC at 760mmHg. |
| Q: What is the polar surface area (PSA) of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole? |
| A: Polar surface area (PSA) of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole is 77.85000. |
| Q: What is the CAS number of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole? |
| A: CAS number of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole is 57237-97-5. |
| Q: What is the English name of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole? |
| A: The English name of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole is 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole. |
| Q: What is the molecular weight of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole? |
| A: Molecular weight of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole is 257.31100. |
| Q: What is the molecular formula of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole? |
| A: Molecular formula of 2-(pyridin-2-ylmethylsulfinyl)-1H-benzimidazole is C13H11N3OS. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |