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448906-42-1,MFCD06411597
Catalog No.:AA00DB62

448906-42-1 | Methyl 2-(1h-indole-3-carbonyl)thiazole-4-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98%
in stock  
$7.00   $5.00
- +
5mg
98%
in stock  
$16.00   $12.00
- +
100mg
97%
in stock  
$162.00   $114.00
- +
250mg
97%
in stock  
$313.00   $219.00
- +
1g
97%
in stock  
$774.00 $542.00
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DB62
Chemical Name:
Methyl 2-(1h-indole-3-carbonyl)thiazole-4-carboxylate
CAS Number:
448906-42-1
Molecular Formula:
C14H10N2O3S
Molecular Weight:
286.3058
MDL Number:
MFCD06411597
SMILES:
COC(=O)c1csc(n1)C(=O)c1c[nH]c2c1cccc2
Properties
Properties
 
BP:
520.4°C at 760 mmHg  
Form:
Solid  
MP:
234 - 236°C  
Solubility:
DMSO: 30 mg/mL, soluble  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
404  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.9  

Literature

Title: Song J, et al. A ligand for the aryl hydrocarbon receptor isolated from lung. Proc Natl Acad Sci U S A. 2002 Nov 12;99(23):14694-9.

Title: Nugent LF, et al. ITE, a novel endogenous nontoxic aryl hydrocarbon receptor ligand, efficiently suppresses EAU and T-cell-mediated immunity. Invest Ophthalmol Vis Sci. 2013 Nov 13;54(12):7463-9.

Title: Pang LP, et al. ITE inhibits growth of human pulmonary artery endothelial cells. Exp Lung Res. 2017 Oct;43(8):283-292.

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SDS
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Tags:448906-42-1 Molecular Formula|448906-42-1 MDL|448906-42-1 SMILES|448906-42-1 Methyl 2-(1h-indole-3-carbonyl)thiazole-4-carboxylate
Catalog No.: AA00DB62
448906-42-1,MFCD06411597
448906-42-1 | Methyl 2-(1h-indole-3-carbonyl)thiazole-4-carboxylate
Pack Size： 1mg
Purity： 98%
in stock
$7.00 $5.00
Pack Size： 5mg
Purity： 98%
in stock
$16.00 $12.00
Pack Size： 100mg
Purity： 97%
in stock
$162.00 $114.00
Pack Size： 250mg
Purity： 97%
in stock
$313.00 $219.00
Pack Size： 1g
Purity： 97%
in stock
$774.00 $542.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA00DB62
Chemical Name: Methyl 2-(1h-indole-3-carbonyl)thiazole-4-carboxylate
CAS Number: 448906-42-1
Molecular Formula: C14H10N2O3S
Molecular Weight: 286.3058
MDL Number: MFCD06411597
SMILES: COC(=O)c1csc(n1)C(=O)c1c[nH]c2c1cccc2
Properties
BP: 520.4°C at 760 mmHg  
Form: Solid  
MP: 234 - 236°C  
Solubility: DMSO: 30 mg/mL, soluble  
Storage: Inert atmosphere;2-8℃;  
Complexity: 404  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 20  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.9  
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