N-Benzoylaminopurine
- CAS No.
- 4005-49-6
- Chemical Name:
- N-Benzoylaminopurine
- Synonyms
- N-BENZOYLADENINE;N6-BENZOYLADENINE;N6-BENZOYLAMINOPURINE;N-BZ-ADE;N4-Bz-adenine;N-(9H-Purin-6-yL;6-BENZAMIDOPURINE;N4-Benzoyl adenine;6-Benzoylaminopurin;N-Benzolaminopurine
- CBNumber:
- CB7165920
- Molecular Formula:
- C12H9N5O
- Molecular Weight:
- 239.23
- MDL Number:
- MFCD00037927
- MOL File:
- 4005-49-6.mol
- MSDS File:
- SDS
| Melting point | 242-244°C |
|---|---|
| Density | 1.494 g/cm3 |
| storage temp. | 2-8°C |
| Water Solubility | Insoluble in water |
| solubility | DMSO (Slightly), Methanol (Slightly) |
| form | powder to crystal |
| pka | 11.98±0.20(Predicted) |
| color | White to Almost white |
| BRN | 20585 |
| InChI | InChI=1S/C12H9N5O/c18-12(8-4-2-1-3-5-8)17-11-9-10(14-6-13-9)15-7-16-11/h1-7H,(H2,13,14,15,16,17,18) |
| InChIKey | QQJXZVKXNSFHRI-UHFFFAOYSA-N |
| SMILES | C(NC1=C2C(=NC=N1)NC=N2)(=O)C1=CC=CC=C1 |
| CAS DataBase Reference | 4005-49-6(CAS DataBase Reference) |
| FDA UNII | 7BQB2WI1II |
| UNSPSC Code | 41106305 |
| NACRES | NA.51 |
SAFETY
Risk and Safety Statements
| Symbol(GHS) |   GHS07,GHS08 |
|||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Signal word | Warning | |||||||||
| Hazard statements | H302-H317-H361d | |||||||||
| Precautionary statements | P202-P261-P280-P301+P312-P302+P352-P308+P313 | |||||||||
| Hazard Codes | Xn,Xi | |||||||||
| Risk Statements | 22-43 | |||||||||
| Safety Statements | 36/37 | |||||||||
| WGK Germany | 3 | |||||||||
| Hazard Note | Irritant | |||||||||
| HS Code | 29335990 | |||||||||
| NFPA 704 |
|
N-Benzoylaminopurine price More Price(37)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Sigma-Aldrich | B5258 | N6-Benzoyladenine ≥99% | 4005-49-6 | 5G | $143.2 | 2024-03-01 | Buy |
| Sigma-Aldrich | B5258 | N6-Benzoyladenine ≥99% | 4005-49-6 | 25G | $864 | 2024-03-01 | Buy |
| TCI Chemical | B3344 | N6-Benzoyladenine >98.0%(HPLC)(T) | 4005-49-6 | 5g | $117 | 2024-03-01 | Buy |
| TCI Chemical | B3344 | N6-Benzoyladenine >98.0%(HPLC)(T) | 4005-49-6 | 25g | $257 | 2024-03-01 | Buy |
| Alfa Aesar | L08292 | N-Benzoylaminopurine, 99% | 4005-49-6 | 1g | $51.65 | 2024-03-01 | Buy |
N-Benzoylaminopurine Chemical Properties,Uses,Production
Chemical Properties
White solid
Uses
N6-Benzoyladenine is used in the organic synthesis of adenine derivative molecules such as bicyclic adenine nucleoside via a condensation reaction between L-threo-pentofuranose derivative 1 and 6-N-benzoyladenine and to produce oxy-peptide nucleic acids.
Definition
ChEBI: 6-Benzamidopurine is a member of purines.
Biochem/physiol Actions
N6-Benzoyladenine comprises of adenine moiety and is a potent inhibitor of bromodomain-containing protein 4 (BRD4). N6-Benzoyladenine modulates tumor necrosis factor α (TNF-α) levels. It elicits cytotoxicity in liver and ileum cancer cells and may serve as a potential candidate agent for cancer chemotherapy.
Synthesis
Benzoyl chloride (1.3 mL, 11 mmol) was added dropwise over 30 min to a stirred suspension of adenine (1.35 g, 10 mmol) in dry pyridine, and stirring was continued at 100 °C for a further 3 h, and the reaction mixture was allowed to stand overnight at room temperature. The reaction was quenched with methanol and the solvents were removed under reduced pressure. The residue was triturated in hot isopropanol and dried in vacuo to give 8 as a white solid: yield 2.15 g (90%). MS (+ESI): m/z 240 [M+H]+; 1H NMR (400 MHz, d-DMSO): δ11.50 (s, 1H), 8.74 (s, 1H), 8.52 (s, 1H), 8.11 (d, 2H, J = 7.2 Hz), 7.66 (t, 1H, J = 7.2 Hz), 7.58 (t, 2H, J = 7.2 Hz).
N-Benzoylaminopurine Preparation Products And Raw materials
| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| Hangzhou Measure Life Technology Co., LTD | +8613343730176 | 2924244016@qq.com | China | 83 | 58 |
| Henan Fengda Chemical Co., Ltd | +86-371-86557731 +86-13613820652 | info@fdachem.com | China | 20260 | 58 |
| Hebei Zhuanglai Chemical Trading Co Ltd | +86-16264648883 +86-16264648883 | niki@zlchemi.com | China | 3712 | 58 |
| Capot Chemical Co.,Ltd. | +86-（0）57185586718 +86-13336195806 | sales@capot.com | China | 29792 | 60 |
| Henan Tianfu Chemical Co.,Ltd. | +86-0371-55170693 +86-19937530512 | info@tianfuchem.com | China | 21632 | 55 |
| career henan chemical co | +86-0371-86658258 +8613203830695 | sales@coreychem.com | China | 29871 | 58 |
| Shanghai Arbor Chemical Co., Ltd. | 021-60451682 | act@arborchemical.com | CHINA | 904 | 58 |
| SHANDONG ZHI SHANG CHEMICAL CO.LTD | +86 18953170293 | sales@sdzschem.com | China | 2930 | 58 |
| Jinan Carbotang Biotech Co.,Ltd. | +8615866703830 | figo.gao@foxmail.com | China | 8497 | 58 |
| Hubei Jusheng Technology Co.,Ltd. | 18871490254 | linda@hubeijusheng.com | CHINA | 28172 | 58 |
View Lastest Price from N-Benzoylaminopurine manufacturers
| Image | Update time | Product | Price | Min. Order | Purity | Supply Ability | Manufacturer | |
|---|---|---|---|---|---|---|---|---|
 |
2025-02-18 | N-(5H-Purin-6-yl)benzamide
4005-49-6
|
US $5.00 / kg | 1kg | ≥98% | 100mt/year | Jinan Finer Chemical Co., Ltd | |
 |
2025-02-18 | N6-Benzoylaminopurine
4005-49-6
|
US $10.00 / kg | 1kg | 99% | 20 ton | Hebei Zhuanglai Chemical Trading Co Ltd | |
 |
2024-10-24 | N4-Bz-adenine
4005-49-6
|
US $0.00-0.00 / mg | 10g | TargetMol Chemicals Inc. |
-
- N-(5H-Purin-6-yl)benzamide
4005-49-6
- US $5.00 / kg
- ≥98%
- Jinan Finer Chemical Co., Ltd
-
- N6-Benzoylaminopurine
4005-49-6
- US $10.00 / kg
- 99%
- Hebei Zhuanglai Chemical Trading Co Ltd
-
- N4-Bz-adenine
4005-49-6
- US $0.00-0.00 / mg
- TargetMol Chemicals Inc.
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