6-Des(diethanolamino)-6-chloro Dipyridamole

Base Information

• Chemical Name: 6-Des(diethanolamino)-6-chloro Dipyridamole
• CAS No.: 54093-92-4
• Molecular Formula: C20H30ClN7O2
• Molecular Weight: 435.957
• Hs Code.: 2933599550
• European Community (EC) Number: 611-094-3
• UNII: AL4Z465RFJ
• DSSTox Substance ID: DTXSID50202431
• Wikidata: Q27273978
• Mol file: 54093-92-4.mol

Synonyms:6-Des(diethanolamino)-6-chloro Dipyridamole;54093-92-4;2-[[2-chloro-4,8-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol;AL4Z465RFJ;2-Diethanolamino-6-chloro-4,8-dipiperidinopyrimido(5,4-d)pyrimidine;2,2'-((6-Chloro-4,8-di(piperidin-1-yl)pyrimido(5,4-d)pyrimidin-2-yl)nitrilo)diethanol;Ethanol, 2,2'-((6-chloro-4,8-di-1-piperidinylpyrimido(5,4-d)pyrimidin-2-yl)imino)bis-;Ethanol, 2,2'-((6-chloro-4,8-dipiperidinopyrimido(5,4-d)pyrimidin-2-yl)imino)di-;Dipyridamole impurity C;2,2'-[[6-Chloro-4,8-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidin-2-yl]nitrilo]diethanol;UNII-AL4Z465RFJ;Dipyridamole impurity C [EP];Dipyridamole Imp. C (EP);Dipyridamole USP Related Compound C;Dipyridamole USP RC C;Dipyridamole Related Compound C;Dipyridamole Impurity C;Dipyridamole specified impurity C [EP];SCHEMBL5055250;DTXSID50202431;DIPYRIDAMOLE IMPURITY C [EP IMPURITY];FT-0665961;A899757;Q27273978

Chemical Property of 6-Des(diethanolamino)-6-chloro Dipyridamole

Chemical Property:

• Vapor Pressure: 2.72E-18mmHg at 25°C
• Melting Point: 155-157℃
• Boiling Point: 659.5°C at 760 mmHg
• PKA: 13.81±0.10(Predicted)
• Flash Point: 352.7°C
• PSA: 101.74000
• Density: 1.366g/cm³
• LogP: 1.97480
• Storage Temp.: -20°C Freezer
• Solubility.: Chloroform (Slightly, Heated), DMSO (Slightly, Heated)
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 7
• Exact Mass: 435.2149509
• Heavy Atom Count: 30
• Complexity: 515

Purity/Quality:

97% ^*data from raw suppliers

6-Des(diethanolamino)-6-chloroDipyridamole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(CC1)C2=NC(=NC3=C2N=C(N=C3N4CCCCC4)N(CCO)CCO)Cl
• Uses: 6-Des(diethanolamino)-6-chloro Dipyridamole (Dipyridamole EP Impurity C) is a Dipyridamole (D492625) impurity. An antitumor nucleoside pyrimido pyrimidine.

Technology Process of 6-Des(diethanolamino)-6-chloro Dipyridamole

There total 2 articles about 6-Des(diethanolamino)-6-chloro Dipyridamole which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

2,6-dichloro-4,8-bis(piperidin-1-yl)pyrimido[5,4-d]pyrimidine (7139-02-8) + 2,2'-iminobis[ethanol] (111-42-2) → 2,2'-(6-chloro-4,8-di-piperidin-1-yl-pyrimido[5,4-d]pyrimidin-2-ylazanediyl)-bis-ethanol (54093-92-4)

Guidance literature:

In dimethyl sulfoxide; at 25 - 125 ℃;

Reference yield:

→ 2,2'-(6-chloro-4,8-di-piperidin-1-yl-pyrimido[5,4-d]pyrimidin-2-ylazanediyl)-bis-ethanol (54093-92-4)

Guidance literature:

/BRN= 598538/ (Vj), mit Triethylamin in Butanol am Rueckfluss kochen;

Reference yield:

2,2'-(6-chloro-4,8-di-piperidin-1-yl-pyrimido[5,4-d]pyrimidin-2-ylazanediyl)-bis-ethanol (54093-92-4) + 2,2'-iminobis[ethanol] (111-42-2) → dipyridamole (58-32-2)

Guidance literature:

at 25 - 115 ℃;

upstream raw materials:

2,6-dichloro-4,8-bis(piperidin-1-yl)pyrimido[5,4-d]pyrimidine

2,2'-iminobis[ethanol]

Downstream raw materials:

dipyridamole

Refernces