3-QUINOXALIN-2-YLPROPANOIC ACID
3-QUINOXALIN-2-YLPROPANOIC ACID structure
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Common Name | 3-QUINOXALIN-2-YLPROPANOIC ACID | ||
|---|---|---|---|---|
| CAS Number | 15741-79-4 | Molecular Weight | 250.33800 | |
| Density | 1.134g/cm3 | Boiling Point | 441.2ºC at 760mmHg | |
| Molecular Formula | C17H18N2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 220.6ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | N-benzyl-2-(1H-indol-3-yl)ethanamine |
|---|---|
| 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 | 1.134g/cm3 |
|---|---|
| Boiling Point | 441.2ºC at 760mmHg |
| Molecular Formula | C17H18N2 |
| Molecular Weight | 250.33800 |
| Flash Point | 220.6ºC |
| Exact Mass | 250.14700 |
| PSA | 27.82000 |
| LogP | 3.89110 |
| Vapour Pressure | 5.56E-08mmHg at 25°C |
| Index of Refraction | 1.652 |
| InChIKey | PRRZWJAGZHENJJ-UHFFFAOYSA-N |
| SMILES | c1ccc(CNCCc2c[nH]c3ccccc23)cc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2933990090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 9 | |
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| DownStream 4 | |
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CAS#:113774-86-0This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933990090 |
|---|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. 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: 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: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979
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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: 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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Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Nb-benzyltryptamine |
| Benzyl-[2-(1H-indol-3-yl)-ethyl]-amine |
| N-Benzyl-1H-indole-3-ethylamine |
| 3-(2-benzylaminoethyl)-indole |
| (2-Indol-3-ylethyl)benzylamine |
| N-benzyl tryptamine |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of N-benzyl-2-(1H-indol-3-yl)ethanamine? |
| A: The English name of N-benzyl-2-(1H-indol-3-yl)ethanamine is N-benzyl-2-(1H-indol-3-yl)ethanamine. |
| Q: What is the polar surface area (PSA) of N-benzyl-2-(1H-indol-3-yl)ethanamine? |
| A: Polar surface area (PSA) of N-benzyl-2-(1H-indol-3-yl)ethanamine is 27.82000. |
| Q: What is the CAS number of N-benzyl-2-(1H-indol-3-yl)ethanamine? |
| A: CAS number of N-benzyl-2-(1H-indol-3-yl)ethanamine is 15741-79-4. |
| Q: What is the SMILES notation of N-benzyl-2-(1H-indol-3-yl)ethanamine? |
| A: SMILES notation of N-benzyl-2-(1H-indol-3-yl)ethanamine is c1ccc(CNCCc2c[nH]c3ccccc23)cc1. |
| Q: What English synonyms does N-benzyl-2-(1H-indol-3-yl)ethanamine have? |
| A: English synonyms of N-benzyl-2-(1H-indol-3-yl)ethanamine: Nb-benzyltryptamine, Benzyl-[2-(1H-indol-3-yl)-ethyl]-amine, N-Benzyl-1H-indole-3-ethylamine, 3-(2-benzylaminoethyl)-indole, (2-Indol-3-ylethyl)benzylamine, N-benzyl tryptamine. |
| Q: What is the InChIKey of N-benzyl-2-(1H-indol-3-yl)ethanamine? |
| A: InChIKey of N-benzyl-2-(1H-indol-3-yl)ethanamine is PRRZWJAGZHENJJ-UHFFFAOYSA-N. |
| Q: What is the boiling point of N-benzyl-2-(1H-indol-3-yl)ethanamine? |
| A: Boiling point of N-benzyl-2-(1H-indol-3-yl)ethanamine is 441.2ºC at 760mmHg. |
| Q: What is the molecular weight of N-benzyl-2-(1H-indol-3-yl)ethanamine? |
| A: Molecular weight of N-benzyl-2-(1H-indol-3-yl)ethanamine is 250.33800. |
| Q: What is the molecular formula of N-benzyl-2-(1H-indol-3-yl)ethanamine? |
| A: Molecular formula of N-benzyl-2-(1H-indol-3-yl)ethanamine is C17H18N2. |
| Q: What is the LogP of N-benzyl-2-(1H-indol-3-yl)ethanamine? |
| A: LogP of N-benzyl-2-(1H-indol-3-yl)ethanamine is 3.89110. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |