4-(Benzo[d]oxazol-2-yl)aniline

Name: 4-(Benzo[d]oxazol-2-yl)aniline
Brand: MedChemExpress
SKU: HY-W029411
Rating: 4.5 (0 reviews)

製品番号: HY-W029411 純度: 99.93%: Data Sheet SDS COA 取扱説明書
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4-(Benzo[d]oxazol-2-yl)aniline is a potent antitumor agent. 4-(Benzo[d]oxazol-2-yl)aniline has inhibitory activity against mammary carcinoma cell lines.

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4-(Benzo[d]oxazol-2-yl)aniline 構造式

CAS 番号 : 20934-81-0

容量	価格（税別）	在庫状況	数量
Solid + Solvent (Highly Recommended)
10 mM * 1 mL in DMSO ready for reconstitution	USD 55	在庫あり	Estimated Time of Arrival: December 31
Solution
10 mM * 1 mL in DMSO	USD 55	在庫あり	Estimated Time of Arrival: December 31
Solid
1 g	$50	在庫あり	Estimated Time of Arrival: December 31
5 g	$80	在庫あり	Estimated Time of Arrival: December 31
10 g	$140	在庫あり	Estimated Time of Arrival: December 31
25 g	$310	在庫あり	Estimated Time of Arrival: December 31
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Based on 0 publication(s) in Google Scholar

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純度とドキュメンテーション
参考文献
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製品説明

4-(Benzo[d]oxazol-2-yl)aniline is a potent antitumor agent. 4-(Benzo[d]oxazol-2-yl)aniline has inhibitory activity against mammary carcinoma cell lines^[1].

Cellular Effect

Cell Line	Type	Value	Description	References
MCF7	IC₅₀	<0.01 μM Compound: 5b	In vitro inhibitory activity against mammary carcinoma MCF-7 cell lines In vitro inhibitory activity against mammary carcinoma MCF-7 cell lines	[PMID: 8765521]
MDA-MB-468	IC₅₀	>1 μM Compound: 5b	In vitro inhibitory activity against mammary carcinoma MDA 468 cell lines In vitro inhibitory activity against mammary carcinoma MDA 468 cell lines	[PMID: 8765521]

体外実験

4-(Benzo[d]oxazol-2-yl)aniline (compound 5b) (0-100 μM; 7 days for MCF-7 and 10 days for MDA 468) has inhibitory activity against MCF-7 and MDA 468 mammary carcinoma cell lines^[1].

MedChemExpress (MCE) has not independently confirmed the accuracy of these methods. They are for reference only.

Cell Proliferation Assay^[1]

Cell Line:	MCF-7 and MDA 468
Concentration:	0-100 μM
Incubation Time:	7 days for MCF-7 and 10 days for MDA 468
Result:	Exhibited inhibitory activity against MCF-7 (IC₅₀>0.01-0.1 μM) and MDA 468 (IC₅₀>0.1-1 μM).

分子量

210.24

分子式

C₁₃H₁₀N₂O

CAS 番号

20934-81-0

Appearance

Solid

Color

Light yellow to brown

SMILES

NC1=CC=C(C=C1)C2=NC3=CC=CC=C3O2

輸送条件

Room temperature in continental US; may vary elsewhere.

保管条件

4°C, protect from light

*In solvent : -80°C, 6 months; -20°C, 1 month (protect from light)

溶剤 & 溶解度

体外:

DMSO : ≥ 100 mg/mL (475.66 mM; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)

*"≥" means soluble, but saturation unknown.

Preparing
Stock Solutions

Concentration Solvent Mass	1 mg	5 mg	10 mg

1 mM	4.7566 mL	23.7828 mL	47.5656 mL
5 mM	0.9513 mL	4.7566 mL	9.5131 mL
10 mM	0.4757 mL	2.3783 mL	4.7566 mL

View the Complete Stock Solution Preparation Table

* Please refer to the solubility information to select the appropriate solvent. Once prepared, please aliquot and store the solution to prevent product inactivation from repeated freeze-thaw cycles.
Storage method and period of stock solution: -80°C, 6 months; -20°C, 1 month (protect from light). When stored at -80°C, please use it within 6 months. When stored at -20°C, please use it within 1 month.

Molarity Calculator
Dilution Calculator

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

一般には略語で表示されます：C₁V₁ = C₂V₂

濃度 _（開始）

体積 _（開始）

濃度 _（終了）

体積 _（終了）

体内:

Select the appropriate dissolution method based on your experimental animal and administration route.

For the following dissolution methods, please ensure to first prepare a clear stock solution using an In Vitro approach and then sequentially add co-solvents:
To ensure reliable experimental results, the clarified stock solution can be appropriately stored based on storage conditions. As for the working solution for in vivo experiments, it is recommended to prepare freshly and use it on the same day.
The percentages shown for the solvents indicate their volumetric ratio in the final prepared solution. If precipitation or phase separation occurs during preparation, heat and/or sonication can be used to aid dissolution.

Protocol 1

Add each solvent one by one: 10% DMSO 40% PEG300 5% Tween-80 45% Saline
Solubility: ≥ 2.5 mg/mL (11.89 mM); Clear solution

This protocol yields a clear solution of ≥ 2.5 mg/mL (saturation unknown).
Taking 1 mL working solution as an example, add 100 μL DMSO stock solution (25.0 mg/mL) to 400 μL PEG300, and mix evenly; then add 50 μL Tween-80 and mix evenly; then add 450 μL Saline to adjust the volume to 1 mL.
Preparation of Saline: Dissolve 0.9 g sodium chloride in ddH₂O and dilute to 100 mL to obtain a clear Saline solution.
Protocol 2

Add each solvent one by one: 10% DMSO 90% (20% SBE-β-CD in Saline)
Solubility: ≥ 2.5 mg/mL (11.89 mM); Clear solution

This protocol yields a clear solution of ≥ 2.5 mg/mL (saturation unknown).
Taking 1 mL working solution as an example, add 100 μL DMSO stock solution (25.0 mg/mL) to 900 μL 20% SBE-β-CD in Saline, and mix evenly.
Preparation of 20% SBE-β-CD in Saline (4°C, storage for one week): 2 g SBE-β-CD powder is dissolved in 10 mL Saline, completely dissolve until clear.

In Vivo Dissolution Calculator

Please enter the basic information of animal experiments:

Dosage

mg/kg

Animal weight
(per animal)

Dosing volume
(per animal)

μL

Number of animals

Recommended: Prepare an additional quantity of animals to account for potential losses during experiments.

Please enter your animal formula composition:

DMSO +

Tween-80 +

Saline

Recommended: Keep the proportion of DMSO in working solution below 2% if your animal is weak.

The co-solvents required include: DMSO, . All of co-solvents are available by MedChemExpress (MCE). , Tween 80. All of co-solvents are available by MedChemExpress (MCE).

Calculation results:

Working solution concentration: mg/mL

Method for preparing stock solution: mg drug dissolved in μL DMSO (Stock solution concentration: mg/mL).

*In solvent : -80°C, 6 months; -20°C, 1 month (protect from light)

The concentration of the stock solution you require exceeds the measured solubility. The following solution is for reference only. If necessary, please contact MedChemExpress (MCE).

Method for preparing in vivo working solution for animal experiments: Take μL DMSO stock solution, add μL . μL , mix evenly, next add μL Tween 80, mix evenly, then add μL Saline.

If the continuous dosing period exceeds half a month, please choose this protocol carefully.

Please ensure that the stock solution in the first step is dissolved to a clear state, and add co-solvents in sequence. You can use ultrasonic heating (ultrasonic cleaner, recommended frequency 20-40 kHz), vortexing, etc. to assist dissolution.

純度とドキュメンテーション

純度: 99.93%

Select Batch:

データシート (271 KB) SDS (480 KB)

COA (245 KB) HNMR (119 KB) RP-HPLC (180 KB) LCMS (255 KB)

取扱説明書 (2659 KB)

参考文献

[1]. Shi DF, et al. Antitumor benzothiazoles. 3. Synthesis of 2-(4-aminophenyl)benzothiazoles and evaluation of their activities against breast cancer cell lines in vitro and in vivo. J Med Chem. 1996 Aug 16;39(17):3375-84. [Content Brief]

Complete Stock Solution Preparation Table

Optional Solvent	Concentration Solvent Mass	1 mg	5 mg	10 mg	25 mg

DMSO	1 mM	4.7566 mL	23.7828 mL	47.5656 mL	118.9140 mL
	5 mM	0.9513 mL	4.7566 mL	9.5131 mL	23.7828 mL
	10 mM	0.4757 mL	2.3783 mL	4.7566 mL	11.8914 mL
	15 mM	0.3171 mL	1.5855 mL	3.1710 mL	7.9276 mL
	20 mM	0.2378 mL	1.1891 mL	2.3783 mL	5.9457 mL
	25 mM	0.1903 mL	0.9513 mL	1.9026 mL	4.7566 mL
	30 mM	0.1586 mL	0.7928 mL	1.5855 mL	3.9638 mL
	40 mM	0.1189 mL	0.5946 mL	1.1891 mL	2.9728 mL
	50 mM	0.0951 mL	0.4757 mL	0.9513 mL	2.3783 mL
	60 mM	0.0793 mL	0.3964 mL	0.7928 mL	1.9819 mL
	80 mM	0.0595 mL	0.2973 mL	0.5946 mL	1.4864 mL
	100 mM	0.0476 mL	0.2378 mL	0.4757 mL	1.1891 mL