+1 858-523-8231
Login | Register
AA Blocks, Building Blocks, Catalysts, Inhibitors
Login | Register
Home Amines 54463-89-7
54463-89-7,MFCD00475875
Catalog No.:AA00DCXK

54463-89-7 | 5-(2-Chlorophenyl)-4h-1,2,4-triazol-3-amine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$123.00   $86.00
- +
5g
95%
in stock  
$489.00   $343.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DCXK
Chemical Name:
5-(2-Chlorophenyl)-4h-1,2,4-triazol-3-amine
CAS Number:
54463-89-7
Molecular Formula:
C8H7ClN4
Molecular Weight:
194.6210
MDL Number:
MFCD00475875
SMILES:
Clc1ccccc1c1nnc([nH]1)N
Properties
Computed Properties
 
Complexity:
178  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
1.9  

Downstream Synthesis Route

[1]CurrentPatentAssignee:SYNERGENICSLCC-WO2014/66743,2014,A1Locationinpatent:Paragraph0146

[2]Naito,Youichiro;Akahoshi,Fumihiko;Takeda,Shinji;Okada,Takehiro;Kajii,Masahiko;Nishimura,Hiroko;Sugiura,Masanori;Fukaya,Chikara;Kagitani,Yoshio[JournalofMedicinalChemistry,1996,vol.39,#15,p.3019-3029]

[3]Bera,Hriday;Lee,MinHuey;Sun,Lingyi;Dolzhenko,AntonV.;Chui,WaiKeung[BioorganicChemistry,2013,vol.50,p.34-40]

556-61-6    54463-89-7   
5-Amino-3-(2-chlorophenyl)-1-methylamino(thiocarbonyl)-1H-1,2,4-triazole 

[1]Naito,Youichiro;Akahoshi,Fumihiko;Takeda,Shinji;Okada,Takehiro;Kajii,Masahiko;Nishimura,Hiroko;Sugiura,Masanori;Fukaya,Chikara;Kagitani,Yoshio[JournalofMedicinalChemistry,1996,vol.39,#15,p.3019-3029]

[1]Naito,Youichiro;Akahoshi,Fumihiko;Takeda,Shinji;Okada,Takehiro;Kajii,Masahiko;Nishimura,Hiroko;Sugiura,Masanori;Fukaya,Chikara;Kagitani,Yoshio[JournalofMedicinalChemistry,1996,vol.39,#15,p.3019-3029]

[1]Dolzhenko,AntonV.;Kalinina,SvetlanaA.;Kalinin,DmitriiV.[RSCAdvances,2013,vol.3,#36,p.15850-15855]

16182-04-0    54463-89-7   
C12H12ClN5O2S 

[1]Bera,Hriday;Lee,MinHuey;Sun,Lingyi;Dolzhenko,AntonV.;Chui,WaiKeung[BioorganicChemistry,2013,vol.50,p.34-40]

Literature

Title: One scaffold, three binding modes: novel and selective pteridine reductase 1 inhibitors derived from fragment hits discovered by virtual screening.

Journal: Journal of medicinal chemistry 20090723

Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Country:
Additional Info:
SDS
Related Products of 54463-89-7
4922-98-9

4922-98-9

 98554-00-8

98554-00-8

 168893-49-0

168893-49-0

 51884-11-8

51884-11-8

 51884-11-8

51884-11-8

 56015-92-0

56015-92-0
Building Blocks
More >
Tags:54463-89-7 Molecular Formula|54463-89-7 MDL|54463-89-7 SMILES|54463-89-7 5-(2-Chlorophenyl)-4h-1,2,4-triazol-3-amine