Pyrrolidine, 1-((1,2,3,4-tetrahydro-3,7-dimethyl-4-oxo-1-(phenylmethyl)-2-thioxopyrido(2,3-d)pyrimidin-6-yl)carbonyl)-

Base Information

Chemical Name:Pyrrolidine, 1-((1,2,3,4-tetrahydro-3,7-dimethyl-4-oxo-1-(phenylmethyl)-2-thioxopyrido(2,3-d)pyrimidin-6-yl)carbonyl)-
CAS No.:109493-32-5
Molecular Formula:C₂₁H₂₂N₄O₂S
Molecular Weight:394.497
Hs Code.:
DSSTox Substance ID:DTXSID00148951
Wikidata:Q83014613
Mol file:109493-32-5.mol

Synonyms:109493-32-5;Pyrrolidine, 1-((1,2,3,4-tetrahydro-3,7-dimethyl-4-oxo-1-(phenylmethyl)-2-thioxopyrido(2,3-d)pyrimidin-6-yl)carbonyl)-;DTXSID00148951;LS-138210

Suppliers and Price of Pyrrolidine, 1-((1,2,3,4-tetrahydro-3,7-dimethyl-4-oxo-1-(phenylmethyl)-2-thioxopyrido(2,3-d)pyrimidin-6-yl)carbonyl)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Pyrrolidine, 1-((1,2,3,4-tetrahydro-3,7-dimethyl-4-oxo-1-(phenylmethyl)-2-thioxopyrido(2,3-d)pyrimidin-6-yl)carbonyl)-

Chemical Property:

Vapor Pressure:2.59E-15mmHg at 25°C
Boiling Point:620.3°Cat760mmHg
Flash Point:329°C
Density:1.38g/cm³
XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:394.14634713
Heavy Atom Count:28
Complexity:630

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C=C2C(=N1)N(C(=S)N(C2=O)C)CC3=CC=CC=C3)C(=O)N4CCCC4

Technology Process of Pyrrolidine, 1-((1,2,3,4-tetrahydro-3,7-dimethyl-4-oxo-1-(phenylmethyl)-2-thioxopyrido(2,3-d)pyrimidin-6-yl)carbonyl)-

There total 2 articles about Pyrrolidine, 1-((1,2,3,4-tetrahydro-3,7-dimethyl-4-oxo-1-(phenylmethyl)-2-thioxopyrido(2,3-d)pyrimidin-6-yl)carbonyl)- 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: 50.0%

: 123-75-1
pyrrolidine

: 109493-21-2
1-benzyl-3,7-dimethyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrido<2,3-d>pyrimidine-6-carboxylic acid chloride

: 109493-32-5
1-Benzyl-3,7-dimethyl-6-(pyrrolidine-1-carbonyl)-2-thioxo-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one

Guidance literature:: In benzene; for 5h; Ambient temperature;

Reference yield:

: 82140-42-9
1-benzyl-3,7-dimethyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrido<2,3-d>pyrimidine-6-carboxylic acid

: 109493-32-5
1-Benzyl-3,7-dimethyl-6-(pyrrolidine-1-carbonyl)-2-thioxo-2,3-dihydro-1H-pyrido[2,3-d]pyrimidin-4-one

Guidance literature:: Multi-step reaction with 2 steps

1: SOCl₂ / benzene / 2 h / 80 - 90 °C

2: 50 percent / benzene / 5 h / Ambient temperature

With thionyl chloride; In benzene;