Home Other Building Blocks 1435488-37-1
1435488-37-1,MFCD26142929
Catalog No.:AA009CCZ

1435488-37-1 | XMD17-109

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98%
in stock  
$34.00   $24.00
- +
2mg
98%
in stock  
$50.00   $35.00
- +
5mg
98%
in stock  
$83.00   $58.00
- +
10mg
98%
in stock  
$123.00   $86.00
- +
50mg
98%
in stock  
$354.00   $248.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA009CCZ
Chemical Name:
XMD17-109
CAS Number:
1435488-37-1
Molecular Formula:
C36H46N8O3
Molecular Weight:
638.8022
MDL Number:
MFCD26142929
SMILES:
CCOc1cc(ccc1Nc1ncc2c(n1)n(C1CCCC1)c1ccccc1c(=O)n2C)C(=O)N1CCC(CC1)N1CCN(CC1)C
Properties
Computed Properties
 
Complexity:
1060  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
47  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
7  
XLogP3:
4.7  

Downstream Synthesis Route

[1]Deng,Xianming;Elkins,JonathanM.;Zhang,Jinwei;Yang,Qingkai;Erazo,Tatiana;Gomez,Nestor;Choi,HwanGeun;Wang,Jinhua;Dzamko,Nicolas;Lee,Jiing-Dwan;Sim,Taebo;Kim,Namdoo;Alessi,DarioR.;Lizcano,JoseM.;Knapp,Stefan;Gray,NathanaelS.[EuropeanJournalofMedicinalChemistry,2013,vol.70,p.758-767]

[1]Deng,Xianming;Elkins,JonathanM.;Zhang,Jinwei;Yang,Qingkai;Erazo,Tatiana;Gomez,Nestor;Choi,HwanGeun;Wang,Jinhua;Dzamko,Nicolas;Lee,Jiing-Dwan;Sim,Taebo;Kim,Namdoo;Alessi,DarioR.;Lizcano,JoseM.;Knapp,Stefan;Gray,NathanaelS.[EuropeanJournalofMedicinalChemistry,2013,vol.70,p.758-767]

[1]EuropeanJournalofMedicinalChemistry,2013,vol.70,p.758-767

Literature

Title: Structural determinants for ERK5 (MAPK7) and leucine rich repeat kinase 2 activities of benzo[e]pyrimido-[5,4-b]diazepine-6(11H)-ones.

Journal: European journal of medicinal chemistry 20131201

Title: Deng X, et al. Structural determinants for ERK5 (MAPK7) and leucine rich repeat kinase 2 activities of benzo[epyrimido-,4-bdiazepine-6(11H)-ones. Eur J Med Chem. 2013;70:758-67.

Title: Elkins, Jonathan M., et al. X-ray Crystal Structure of ERK5 (MAPK7) in Complex with a Specific Inhibitor. Journal of Medicinal Chemistry (2013), 56(11), 4413-4421.

Title: Wilhelmsen K, et al. Extracellular signal-regulated kinase 5 promotes acute cellular and systemic inflammation. Sci Signal. 2015 Aug 25;8(391):ra86.

Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Country:
Additional Info:
SDS
Related Products of 1435488-37-1
Tags:1435488-37-1 Molecular Formula|1435488-37-1 MDL|1435488-37-1 SMILES|1435488-37-1 XMD17-109