N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide
N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide structure
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Common Name | N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide | ||
|---|---|---|---|---|
| CAS Number | 76732-75-7 | Molecular Weight | 238.37200 | |
| Density | 1.241g/cm3 | Boiling Point | 390.3ºC at 760 mmHg | |
| Molecular Formula | C11H14N2S2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 189.8ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide |
|---|---|
| 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 | 1.241g/cm3 |
|---|---|
| Boiling Point | 390.3ºC at 760 mmHg |
| Molecular Formula | C11H14N2S2 |
| Molecular Weight | 238.37200 |
| Flash Point | 189.8ºC |
| Exact Mass | 238.06000 |
| PSA | 82.31000 |
| LogP | 2.74160 |
| Index of Refraction | 1.639 |
| InChIKey | ITNLONMDUMHEOK-UHFFFAOYSA-N |
| SMILES | CNC(=S)C1(c2ccccn2)CCCS1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2934999090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~81%
N-methyl-2-pyri... CAS#:76732-75-7 |
| Literature: Aloup, Jean-Claude; Bouchaudon, Jean; Farge, Daniel; James, Claude; Deregnaucourt, Jean; Hardy-Houis, Monique Journal of Medicinal Chemistry, 1987 , vol. 30, # 1 p. 24 - 29 |
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~%
N-methyl-2-pyri... CAS#:76732-75-7 |
| Literature: Aloup, Jean-Claude; Bouchaudon, Jean; Farge, Daniel; James, Claude; Deregnaucourt, Jean; Hardy-Houis, Monique Journal of Medicinal Chemistry, 1987 , vol. 30, # 1 p. 24 - 29 |
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~%
N-methyl-2-pyri... CAS#:76732-75-7 |
| Literature: Aloup, Jean-Claude; Bouchaudon, Jean; Farge, Daniel; James, Claude; Deregnaucourt, Jean; Hardy-Houis, Monique Journal of Medicinal Chemistry, 1987 , vol. 30, # 1 p. 24 - 29 |
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~%
N-methyl-2-pyri... CAS#:76732-75-7 |
| Literature: Aloup, Jean-Claude; Bouchaudon, Jean; Farge, Daniel; James, Claude; Deregnaucourt, Jean; Hardy-Houis, Monique Journal of Medicinal Chemistry, 1987 , vol. 30, # 1 p. 24 - 29 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Antisecretory activity against histamine stimulated gastric acid secretion in Shay ra...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL780314
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Name: Enzymatic assay of human HDAC6 with commercial peptide substrate
Source: ChEMBL
Target: Histone deacetylase 6
External Id: CHEMBL4808149
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Name: Enzymatic assay of human HDAC6 with custom peptide substrate
Source: ChEMBL
Target: Histone deacetylase 6
External Id: CHEMBL4808150
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Name: Antiulcer activity against histamine stimulated gastric acid secretion in Shay rats e...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL779985
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Name: Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of VER...
Source: ChEMBL
Target: Severe acute respiratory syndrome coronavirus 2
External Id: CHEMBL4513082
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Name: Antiulcer activity by protection of restraint-induced gastric erosions in rats, by us...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL789059
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Name: Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of Cac...
Source: ChEMBL
Target: Severe acute respiratory syndrome coronavirus 2
External Id: CHEMBL4303805
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Name: SARS-CoV-2 3CL-Pro protease inhibition percentage at 20µM by FRET kind of response f...
Source: ChEMBL
Target: Replicase polyprotein 1ab
External Id: CHEMBL4495582
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Picartamidum |
| N-methyl-2-(pyrid-2-yl)tetrahydrothiophene-2-carbothioamide |
| N-methyl-2-(2-pyridyl)tetrahydrothiophene-2-carbothioamide |
| Picartamidum [Latin] |
| Picartamide |
| Picartamida |
| Picartamida [Spanish] |
| 2-Thiophenecarbothioamide,tetrahydro-N-methyl-2-(2-pyridinyl) |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular formula of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide? |
| A: Molecular formula of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide is C11H14N2S2. |
| Q: What is the InChIKey of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide? |
| A: InChIKey of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide is ITNLONMDUMHEOK-UHFFFAOYSA-N. |
| Q: What are the upstream materials of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide? |
| A: Related upstream materials(CAS) of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide: 76743-15-2;74-89-5;2044-73-7;6959-47-3;1822-49-7. |
| Q: What is the boiling point of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide? |
| A: Boiling point of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide is 390.3ºC at 760 mmHg. |
| Q: What is the SMILES notation of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide? |
| A: SMILES notation of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide is CNC(=S)C1(c2ccccn2)CCCS1. |
| Q: What English synonyms does N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide have? |
| A: English synonyms of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide: Picartamidum, N-methyl-2-(pyrid-2-yl)tetrahydrothiophene-2-carbothioamide, N-methyl-2-(2-pyridyl)tetrahydrothiophene-2-carbothioamide, Picartamidum [Latin], Picartamide, Picartamida, Picartamida [Spanish], 2-Thiophenecarbothioamide,tetrahydro-N-methyl-2-(2-pyridinyl). |
| Q: What is the CAS number of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide? |
| A: CAS number of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide is 76732-75-7. |
| Q: What is the LogP of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide? |
| A: LogP of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide is 2.74160. |
| Q: What is the polar surface area (PSA) of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide? |
| A: Polar surface area (PSA) of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide is 82.31000. |
| Q: What is the molecular weight of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide? |
| A: Molecular weight of N-methyl-2-pyridin-2-ylthiolane-2-carbothioamide is 238.37200. |