ETHANONE, 1-PHENYL-2-(1H-1,2,4-TRIAZOL-1-YL)
ETHANONE, 1-PHENYL-2-(1H-1,2,4-TRIAZOL-1-YL) structure
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Common Name | ETHANONE, 1-PHENYL-2-(1H-1,2,4-TRIAZOL-1-YL) | ||
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| CAS Number | 58905-26-3 | Molecular Weight | 187.19800 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C10H9N3O | 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 | 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone |
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| 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 | C10H9N3O |
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| Molecular Weight | 187.19800 |
| Exact Mass | 187.07500 |
| PSA | 47.78000 |
| LogP | 1.16100 |
| InChIKey | RXGNQUOYJPSWRW-UHFFFAOYSA-N |
| SMILES | O=C(Cn1cncn1)c1ccccc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xn |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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Name: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Dicer-mediated maturation of pre-microRNA
Source: Center for Chemical Genomics, University of Michigan
Target: N/A
External Id: TargetID_659_CEMA
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| hms2750o13 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone? |
| A: Polar surface area (PSA) of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone is 47.78000. |
| Q: What is the InChIKey of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone? |
| A: InChIKey of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone is RXGNQUOYJPSWRW-UHFFFAOYSA-N. |
| Q: What English synonyms does 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone have? |
| A: English synonyms of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone: hms2750o13. |
| Q: What is the molecular weight of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone? |
| A: Molecular weight of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone is 187.19800. |
| Q: What is the English name of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone? |
| A: The English name of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone is 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone. |
| Q: What is the molecular formula of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone? |
| A: Molecular formula of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone is C10H9N3O. |
| Q: What is the LogP of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone? |
| A: LogP of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone is 1.16100. |
| Q: What is the CAS number of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone? |
| A: CAS number of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone is 58905-26-3. |
| Q: What is the SMILES notation of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone? |
| A: SMILES notation of 1-phenyl-2-(1,2,4-triazol-1-yl)ethanone is O=C(Cn1cncn1)c1ccccc1. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |