D-69491 (hydrochloride)

Base Information

• Chemical Name: D-69491 (hydrochloride)
• CAS No.: 346599-65-3
• Molecular Formula: C25H25ClFN7O3.HCl
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID30701210

Synonyms:D-69491 (hydrochloride);DTXSID30701210;CLVDFRRQUCVMJY-UHFFFAOYSA-N;5-[4-(3-chloro-4-fluoro-phenylamino)-6-oxo-6,7-dihydro-pyrrolo [2,3-d]pyrimidin-5-ylidenemethyl]-4-methyl-1H-pyrrole-2-carboxylic acid (2-morpholin-4-yl-ethyl)-amide hydrochloride;PD118440;5-[4-(3-chloro-4-fluoro-phenylamino)-6-oxo-6,7-dihydro-pyrrolo[2,3-d]pyrimidin-5-ylidenemethyl]-4-methyl-1H-pyrrole-2-carboxylic acid (2-morpholin-4-yl-ethyl)-amide hydrochloride;5-{[4-(3-Chloro-4-fluoroanilino)-6-oxo-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-5-ylidene]methyl}-4-methyl-N-[2-(morpholin-4-yl)ethyl]-1H-pyrrole-2-carboxamide--hydrogen chloride (1/1)

Chemical Property of D-69491 (hydrochloride)

Chemical Property:

• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 561.1458213
• Heavy Atom Count: 38
• Complexity: 860

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(NC(=C1)C(=O)NCCN2CCOCC2)C=C3C4=C(NC3=O)N=CN=C4NC5=CC(=C(C=C5)F)Cl.Cl

Technology Process of D-69491 (hydrochloride)

There total 1 articles about D-69491 (hydrochloride) 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:

1-methyl-pyrrolidin-2-one (872-50-4,26138-58-9) + 5-(4-chloro-6-oxo-6,7-dihydro-pyrrolo[2,3-d]pyrimidin-5-ylidenemethyl)-4-methyl-1H-pyrrole-2-carboxylic acid (2-morpholin-4-yl-ethyl)-amide + 3-chloro-4-fluorophenylamine (367-21-5) + diethylene glycol dimethyl ether (111-96-6) → 5-[4-(3-Chloro-4-fluoro-phenylamino)-6-oxo-6,7-dihydro-pyrrolo [2,3-d]pyrimidin-5-ylidenemethyl]-4-methyl-1H-pyrrole-2-carboxylic acid (2-morpholin-4-yl-ethyl)-amide (499134-60-0) + 5-[4-(3-chloro-4-fluoro-phenylamino)-6-oxo-6,7-dihydro-pyrrolo [2,3-d]pyrimidin-5-ylidenemethyl]-4-methyl-1H-pyrrole-2-carboxylic acid (2-morpholin-4-yl-ethyl)-amide hydrochloride (346599-65-3)

Guidance literature:

With p-toluenesulfonic acid monohydrate; In hydrogenchloride;

upstream raw materials:

1-methyl-pyrrolidin-2-one

3-chloro-4-fluorophenylamine

diethylene glycol dimethyl ether

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