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500-42-5,MFCD00023181
Catalog No.:AA00DI67

500-42-5 | N-(4-Chlorophenyl)-1,3,5-triazine-2,4-diamine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
1 week  
$146.00   $102.00
- +
100mg
95%
1 week  
$193.00   $135.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DI67
Chemical Name:
N-(4-Chlorophenyl)-1,3,5-triazine-2,4-diamine
CAS Number:
500-42-5
Molecular Formula:
C9H8ClN5
Molecular Weight:
221.6463
MDL Number:
MFCD00023181
SMILES:
Clc1ccc(cc1)Nc1ncnc(n1)N
Properties
Computed Properties
 
Complexity:
195  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
2.1  

Downstream Synthesis Route
64-18-6   
1-(4-chlorophenyl)biguanidehydrochloride 
  500-42-5 

[1]Clauder;Bulcsu[MagyarKemiaiFolyoirat,1951,vol.57,p.68,71][Chem.Abstr.,1952,p.4023]CurrentPatentAssignee:LUDWIGHEUMANNCHEMPHARM-DE1008303,1955,B

[1]Shapiroetal.[JournaloftheAmericanChemicalSociety,1957,vol.79,p.5064,5069][JournaloftheAmericanChemicalSociety,1959,vol.81,p.3728,3729]

[1]Clauder;Bulcsu[MagyarKemiaiFolyoirat,1951,vol.57,p.68,71][Chem.Abstr.,1952,p.4023]CurrentPatentAssignee:LUDWIGHEUMANNCHEMPHARM-DE1008303,1955,B

[1]Clauder;Bulcsu[MagyarKemiaiFolyoirat,1951,vol.57,p.68,71][Chem.Abstr.,1952,p.4023]CurrentPatentAssignee:LUDWIGHEUMANNCHEMPHARM-DE1008303,1955,B

Literature

Title: [Acute interstitial nephritis caused by drugs].

Journal: Deutsche medizinische Wochenschrift (1946) 19830520

Title: Thevis M, et al. Formation of the diuretic chlorazanil from the antimalarial drug proguanil--implications for sports drug testing. J Pharm Biomed Anal. 2015 Nov 10;115:208-13.

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SDS
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Tags:500-42-5 Molecular Formula|500-42-5 MDL|500-42-5 SMILES|500-42-5 N-(4-Chlorophenyl)-1,3,5-triazine-2,4-diamine
Catalog No.: AA00DI67
500-42-5,MFCD00023181
500-42-5 | N-(4-Chlorophenyl)-1,3,5-triazine-2,4-diamine
Pack Size： 50mg
Purity： 95%
1 week
$146.00 $102.00
Pack Size： 100mg
Purity： 95%
1 week
$193.00 $135.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00DI67
Chemical Name: N-(4-Chlorophenyl)-1,3,5-triazine-2,4-diamine
CAS Number: 500-42-5
Molecular Formula: C9H8ClN5
Molecular Weight: 221.6463
MDL Number: MFCD00023181
SMILES: Clc1ccc(cc1)Nc1ncnc(n1)N
Properties
Complexity: 195  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 2  
Rotatable Bond Count: 2  
XLogP3: 2.1  
Downstream Synthesis Route
64-18-6   
1-(4-chlorophenyl)biguanidehydrochloride 
  500-42-5 

[1]Clauder;Bulcsu[MagyarKemiaiFolyoirat,1951,vol.57,p.68,71][Chem.Abstr.,1952,p.4023]CurrentPatentAssignee:LUDWIGHEUMANNCHEMPHARM-DE1008303,1955,B

106-47-8    780722-26-1    109-94-4    500-42-5 

[1]Shapiroetal.[JournaloftheAmericanChemicalSociety,1957,vol.79,p.5064,5069][JournaloftheAmericanChemicalSociety,1959,vol.81,p.3728,3729]

64-18-6    5304-59-6    500-42-5 

[1]Clauder;Bulcsu[MagyarKemiaiFolyoirat,1951,vol.57,p.68,71][Chem.Abstr.,1952,p.4023]CurrentPatentAssignee:LUDWIGHEUMANNCHEMPHARM-DE1008303,1955,B

64-18-6    500-42-5 

[1]Clauder;Bulcsu[MagyarKemiaiFolyoirat,1951,vol.57,p.68,71][Chem.Abstr.,1952,p.4023]CurrentPatentAssignee:LUDWIGHEUMANNCHEMPHARM-DE1008303,1955,B

Literature fold

Title: [Acute interstitial nephritis caused by drugs].

Journal: Deutsche medizinische Wochenschrift (1946)19830520

Title: Thevis M, et al. Formation of the diuretic chlorazanil from the antimalarial drug proguanil--implications for sports drug testing. J Pharm Biomed Anal. 2015 Nov 10;115:208-13.

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