N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide
N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide structure
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Common Name | N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide | ||
|---|---|---|---|---|
| CAS Number | 89652-23-3 | Molecular Weight | 268.37700 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C16H16N2S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | N-phenyl-3,4-dihydro-1H-isoquinoline-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.
| Molecular Formula | C16H16N2S |
|---|---|
| Molecular Weight | 268.37700 |
| Exact Mass | 268.10300 |
| PSA | 54.40000 |
| LogP | 3.60010 |
| InChIKey | FAPOHPPTCHNTGU-UHFFFAOYSA-N |
| SMILES | S=C(Nc1ccccc1)N1CCc2ccccc2C1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~99%
N-phenyl-3,4-di... CAS#:89652-23-3 |
| Literature: Zhang, Wei; Chen, Christine Hiu-Tung; Nagashima, Tadamichi Tetrahedron Letters, 2003 , vol. 44, # 10 p. 2065 - 2068 |
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~%
N-phenyl-3,4-di... CAS#:89652-23-3 |
| Literature: Bamberger; Dieckmann Chemische Berichte, 1893 , vol. 26, p. 1211 |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
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Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN
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Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3,4-dihydro-1H-isoquinoline-2-carbothioic acid phenylamide |
| 3,4-dihydro-1H-isoquinoline-2-carbothioic acid anilide |
| 3,4-Dihydro-1H-isochinolin-2-thiocarbonsaeure-anilid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide? |
| A: Molecular weight of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide is 268.37700. |
| Q: What English synonyms does N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide have? |
| A: English synonyms of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide: 3,4-dihydro-1H-isoquinoline-2-carbothioic acid phenylamide, 3,4-dihydro-1H-isoquinoline-2-carbothioic acid anilide, 3,4-Dihydro-1H-isochinolin-2-thiocarbonsaeure-anilid. |
| Q: What is the SMILES notation of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide? |
| A: SMILES notation of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide is S=C(Nc1ccccc1)N1CCc2ccccc2C1. |
| Q: What is the Chinese name of 89652-23-3? |
| A: Chinese name of 89652-23-3 is 89652-23-3. |
| Q: What is the LogP of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide? |
| A: LogP of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide is 3.60010. |
| Q: What is the molecular formula of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide? |
| A: Molecular formula of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide is C16H16N2S. |
| Q: What is the English name of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide? |
| A: The English name of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide is N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide. |
| Q: What is the InChIKey of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide? |
| A: InChIKey of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide is FAPOHPPTCHNTGU-UHFFFAOYSA-N. |
| Q: What is the polar surface area (PSA) of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide? |
| A: Polar surface area (PSA) of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide is 54.40000. |
| Q: What is the CAS number of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide? |
| A: CAS number of N-phenyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide is 89652-23-3. |