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1472795-20-2,MFCD28133395
Catalog No.:AA00ABHR

1472795-20-2 | Krca-0008

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98+%
in stock  
$15.00   $11.00
- +
5mg
98+%
in stock  
$38.00   $27.00
- +
10mg
98+%
in stock  
$56.00   $39.00
- +
25mg
98+%
in stock  
$94.00   $66.00
- +
50mg
98+%
in stock  
$158.00   $111.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00ABHR
Chemical Name:
Krca-0008
CAS Number:
1472795-20-2
Molecular Formula:
C30H37ClN8O4
Molecular Weight:
609.1190
MDL Number:
MFCD28133395
SMILES:
COc1cc(ccc1Nc1ncc(c(n1)Nc1ccc(cc1OC)N1CCN(CC1)C(=O)C)Cl)N1CCN(CC1)C(=O)C
Properties
Computed Properties
 
Complexity:
919  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
43  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
8  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.3  

Downstream Synthesis Route

[1]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

[2]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

[1]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

[2]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

[1]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

[2]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

[1]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

[1]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

Literature

Title: Park CH, et al. Novel bis-ortho-alkoxy-para-piperazinesubstituted-2,4-dianilinopyrimidines (KRCA-0008) as potent and selective ALK inhibitors for anticancer treatment. Bioorg Med Chem Lett. 2013 Nov 15;23(22):6192-6.

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Tags:1472795-20-2 Molecular Formula|1472795-20-2 MDL|1472795-20-2 SMILES|1472795-20-2 Krca-0008
Catalog No.: AA00ABHR
1472795-20-2,MFCD28133395
1472795-20-2 | Krca-0008
Pack Size： 1mg
Purity： 98+%
in stock
$15.00 $11.00
Pack Size： 5mg
Purity： 98+%
in stock
$38.00 $27.00
Pack Size： 10mg
Purity： 98+%
in stock
$56.00 $39.00
Pack Size： 25mg
Purity： 98+%
in stock
$94.00 $66.00
Pack Size： 50mg
Purity： 98+%
in stock
$158.00 $111.00
Quantity
- +
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bulk Quotation Request
Technical Information
Catalog Number: AA00ABHR
Chemical Name: Krca-0008
CAS Number: 1472795-20-2
Molecular Formula: C30H37ClN8O4
Molecular Weight: 609.1190
MDL Number: MFCD28133395
SMILES: COc1cc(ccc1Nc1ncc(c(n1)Nc1ccc(cc1OC)N1CCN(CC1)C(=O)C)Cl)N1CCN(CC1)C(=O)C
Properties
Complexity: 919  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 43  
Hydrogen Bond Acceptor Count: 10  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 8  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.3  
Downstream Synthesis Route
446-36-6    1472795-20-2 

[1]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

[2]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

448-19-1    1472795-20-2 

[1]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

[2]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

1116229-11-8    1472795-20-2 

[1]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

[2]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

1021426-42-5    1472795-13-3    1472795-20-2 

[1]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

1021426-42-5    1472795-20-2 

[1]Park,ChiHoon;Choe,Hyeonjeong;Jang,In-Young;Kwon,SoYeong;Latif,Muhammad;Lee,HeungKyoung;Lee,HyeonJi;Yang,EunHye;Yun,JeongIn;Chae,ChongHak;Cho,SungYun;Choi,SangUn;Ha,JaeDu;Jung,Heejung;Kim,HyoungRae;Kim,Pilho;Lee,ChongOck;Yun,Chang-Soo;Lee,Kwangho[BioorganicandMedicinalChemistryLetters,2013,vol.23,#22,p.6192-6196]

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