2-benzenesulfonamidopyrimidine
2-benzenesulfonamidopyrimidine structure
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Common Name | 2-benzenesulfonamidopyrimidine | ||
|---|---|---|---|---|
| CAS Number | 16699-12-0 | Molecular Weight | 235.26200 | |
| Density | 1.425g/cm3 | Boiling Point | 443ºC at 760mmHg | |
| Molecular Formula | C10H9N3O2S | Melting Point | 229-230 °C | |
| MSDS | N/A | Flash Point | 221.7ºC | |
Summary: 2-phenylsulfamidopyrimidine (N-pyrimidin-2-ylbenzenesulfonamide), with a molecular formula of C10H9N3O2S and a molecular weight of 235.26200. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | N-pyrimidin-2-ylbenzenesulfonamide |
|---|---|
| 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 | 1.425g/cm3 |
|---|---|
| Boiling Point | 443ºC at 760mmHg |
| Melting Point | 229-230 °C |
| Molecular Formula | C10H9N3O2S |
| Molecular Weight | 235.26200 |
| Flash Point | 221.7ºC |
| Exact Mass | 235.04200 |
| PSA | 80.33000 |
| LogP | 2.43120 |
| Vapour Pressure | 4.81E-08mmHg at 25°C |
| Index of Refraction | 1.641 |
| InChIKey | HLBLNLYCFFWMFF-UHFFFAOYSA-N |
| SMILES | O=S(=O)(Nc1ncccn1)c1ccccc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2935009090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~83%
2-benzenesulfon... CAS#:16699-12-0 |
| Literature: Wang, Xiang; Guram, Anil; Ronk, Michael; Milne, Jacqueline E.; Tedrow, Jason S.; Faul, Margaret M. Tetrahedron Letters, 2012 , vol. 53, # 1 p. 7 - 10 |
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~97%
2-benzenesulfon... CAS#:16699-12-0 |
| Literature: Auxiliadora Dea-Ayuela; Castillo, Encarna; Gonzalez-Alvarez, Marta; Vega, Celeste; Rolon, Miriam; Bolas-Fernandez, Francisco; Borras, Joaquin; Eugenia Gonzalez-Rosende Bioorganic and Medicinal Chemistry, 2009 , vol. 17, # 21 p. 7449 - 7456 |
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~%
2-benzenesulfon... CAS#:16699-12-0 |
| Literature: Ohta; Kawasaki Yakugaku Zasshi, 1951 , vol. 71, p. 1420 Chem.Abstr., 1952 , p. 8095 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
|---|---|
| DownStream 1 | |
CAS#:5433-20-5This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2935009090 |
|---|---|
| Summary | 2935009090 other sulphonamides VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:35.0% |
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: 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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Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id: SIAE_INH_FP_1536_1X%INH PRUN
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| N-Pyrimidin-2-yl-benzolsulfonamid |
| N-Pyrimidin-2-yl-benzenesulfonamide |
| 2-Benzenesulfonamidopyrimidine |
| benzenesulfonamidopyrimidine |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of N-pyrimidin-2-ylbenzenesulfonamide? |
| A: LogP of N-pyrimidin-2-ylbenzenesulfonamide is 2.43120. |
| Q: What is the melting point of N-pyrimidin-2-ylbenzenesulfonamide? |
| A: Melting point of N-pyrimidin-2-ylbenzenesulfonamide is 229-230 °C. |
| Q: What is the CAS number of N-pyrimidin-2-ylbenzenesulfonamide? |
| A: CAS number of N-pyrimidin-2-ylbenzenesulfonamide is 16699-12-0. |
| Q: What is the molecular formula of N-pyrimidin-2-ylbenzenesulfonamide? |
| A: Molecular formula of N-pyrimidin-2-ylbenzenesulfonamide is C10H9N3O2S. |
| Q: What is the polar surface area (PSA) of N-pyrimidin-2-ylbenzenesulfonamide? |
| A: Polar surface area (PSA) of N-pyrimidin-2-ylbenzenesulfonamide is 80.33000. |
| Q: What are the upstream materials of N-pyrimidin-2-ylbenzenesulfonamide? |
| A: Related upstream materials(CAS) of N-pyrimidin-2-ylbenzenesulfonamide: 98-10-2;4595-60-2;109-12-6;98-09-9. |
| Q: What is the boiling point of N-pyrimidin-2-ylbenzenesulfonamide? |
| A: Boiling point of N-pyrimidin-2-ylbenzenesulfonamide is 443ºC at 760mmHg. |
| Q: What is the molecular weight of N-pyrimidin-2-ylbenzenesulfonamide? |
| A: Molecular weight of N-pyrimidin-2-ylbenzenesulfonamide is 235.26200. |
| Q: What is the SMILES notation of N-pyrimidin-2-ylbenzenesulfonamide? |
| A: SMILES notation of N-pyrimidin-2-ylbenzenesulfonamide is O=S(=O)(Nc1ncccn1)c1ccccc1. |
| Q: What English synonyms does N-pyrimidin-2-ylbenzenesulfonamide have? |
| A: English synonyms of N-pyrimidin-2-ylbenzenesulfonamide: N-Pyrimidin-2-yl-benzolsulfonamid, N-Pyrimidin-2-yl-benzenesulfonamide, 2-Benzenesulfonamidopyrimidine, benzenesulfonamidopyrimidine. |
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. |