B5258

N6-Benzoyladenine

≥99%

Manufacturer: Sigma Aldrich

CAS Number: 4005-49-6

Synonym(S): 6-(Benzoylamino)purine, 6-Benzamidopurine, 6-Benzoyladenine, n6-benzoyl adenosine

Select a Size

Pack Size SKU Availability Price
5 G B5258-5-G In Stock ₹ 40,048.80
25 G B5258-25-G In Stock ₹ 1,34,354.40

B5258 - 5 G

₹ 40,048.80

In Stock

Quantity

1

Base Price: ₹ 40,048.80

GST (18%): ₹ 7,208.784

Total Price: ₹ 47,257.584

Quality Level

200

Assay

≥99%

form

powder

solubility

warm ethanol: 10 mg/mL, clear to slightly hazy, colorless to faintly yellow

storage temp.

2-8°C

SMILES string

O=C(Nc1ncnc2nc[nH]c12)c3ccccc3

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)

InChI key

QQJXZVKXNSFHRI-UHFFFAOYSA-N

Other Options

Image Product Name Manufacturer Price Range
50-197-1977
Chemscene AbaChemscene,N-(7H-Purin-6-yl)benzamide,4005-49-6,10g,Formula:C12H9N5O,M. Wt. 239.24,>98%
Chemscene ₹ 1,917.40
CS-W014659
N-(7H-Purin-6-yl)benzamide
ChemScene ₹ 427.80 - ₹ 23,443.44

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Description

  • Application: 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.
  • Biochem/physiol Actions: N6-Benzoyladenine comprises of adenine moiety and is a potent inhibitor of bromodomain-containing protein 4 (BRD4).[1] N6-Benzoyladenine modulates tumor necrosis factor α (TNF-α) levels.[2] It elicits cytotoxicity in liver and ileum cancer cells[3] and may serve as a potential candidate agent for cancer chemotherapy.[2]

SAFETY INFORMATION

Pictograms

GHS08,GHS07

Signal Word

Warning

Hazard Statements

H302,H317,H361d

Precautionary Statements

P202 - P261 - P280 - P301 + P312 - P302 + P352 - P308 + P313

Hazard Classifications

Acute Tox. 4 Oral - Repr. 2 - Skin Sens. 1

WGK

WGK 3

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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powder

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SMILES string:
O=C(Nc1ncnc2nc[nH]c12)c3ccccc3

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)

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QQJXZVKXNSFHRI-UHFFFAOYSA-N

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OS(O)(=O)=O.NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O

InChI:
1S/C18H37N5O10.H2O4S/c19-2-6-11(26)12(27)9(23)17(30-6)32-15-4(20)1-5(21)16(14(15)29)33-18-13(28)8(22)10(25)7(3-24)31-18;1-5(2,3)4/h4-18,24-29H,1-3,19-23H2;(H2,1,2,3,4)/t4-,5+,6+,7+,8-,9+,10+,11+,12+,13+,14-,15+,16-,17+,18+;/m0./s1

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YGTPKDKJVZOVCO-KELBJJLKSA-N

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OS(O)(=O)=O.NC[C@H]1O[C@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H]2O)[C@H](N)[C@@H](O)[C@@H]1O

InChI:
1S/C18H37N5O10.H2O4S/c19-2-6-11(26)12(27)9(23)17(30-6)32-15-4(20)1-5(21)16(14(15)29)33-18-13(28)8(22)10(25)7(3-24)31-18;1-5(2,3)4/h4-18,24-29H,1-3,19-23H2;(H2,1,2,3,4)/t4-,5+,6+,7+,8-,9+,10+,11+,12+,13+,14-,15+,16-,17+,18+;/m0./s1

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YGTPKDKJVZOVCO-KELBJJLKSA-N

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SMILES string:
O.Cl.CCCCN1CCCCC1C(=O)Nc2c(C)cccc2C

InChI:
1S/C18H28N2O.ClH.H2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3;;/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21);1H;1H2

InChI key:
HUCIWBPMHXGLFM-UHFFFAOYSA-N