5H-Pyrrolo(3,2-d)pyrimidine-2,4-diamine, N,N'-bis(4-methoxyphenyl)-

Base Information

Chemical Name:5H-Pyrrolo(3,2-d)pyrimidine-2,4-diamine, N,N'-bis(4-methoxyphenyl)-
CAS No.:114685-02-8
Molecular Formula:C₂₀H₁₉N₅O₂
Molecular Weight:361.403
Hs Code.:
DSSTox Substance ID:DTXSID30150820
Wikidata:Q83017023
ChEMBL ID:CHEMBL577457
Mol file:114685-02-8.mol

Synonyms:BRN 5773647;GNF-Pf-1650;5H-Pyrrolo(3,2-d)pyrimidine-2,4-diamine, N,N'-bis(4-methoxyphenyl)-;N,N-Bis(4-methoxyphenyl)-5H-pyrrolo(3,2-d)pyrimidine-2,4-diamine;114685-02-8;CHEMBL577457;DTXSID30150820;LS-139564

Suppliers and Price of 5H-Pyrrolo(3,2-d)pyrimidine-2,4-diamine, N,N'-bis(4-methoxyphenyl)-

Supply Marketing:

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

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Chemical Property of 5H-Pyrrolo(3,2-d)pyrimidine-2,4-diamine, N,N'-bis(4-methoxyphenyl)-

Chemical Property:

Boiling Point:635.4°Cat760mmHg
Flash Point:338.1°C
Density:1.346g/cm³
XLogP3:4.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:361.15387487
Heavy Atom Count:27
Complexity:452

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC=C(C=C1)NC2=NC(=NC3=C2NC=C3)NC4=CC=C(C=C4)OC

Technology Process of 5H-Pyrrolo(3,2-d)pyrimidine-2,4-diamine, N,N'-bis(4-methoxyphenyl)-

There total 5 articles about 5H-Pyrrolo(3,2-d)pyrimidine-2,4-diamine, N,N'-bis(4-methoxyphenyl)- 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: 85.2%

: 104-94-9
4-methoxy-aniline

: 63200-54-4
2,4-dichloro-5H-pyrrolo[3,2-d]pyrimidine

: 114685-02-8
N²,N⁴-Bis-(4-methoxy-phenyl)-5H-pyrrolo[3,2-d]pyrimidine-2,4-diamine

Guidance literature:: In ethanol; for 8.5h; Heating;
DOI:10.1007/BF00758443

Reference yield:

: 16632-21-6
5-nitro-6-methyluracil

: 114685-02-8
N²,N⁴-Bis-(4-methoxy-phenyl)-5H-pyrrolo[3,2-d]pyrimidine-2,4-diamine

Guidance literature:: Multi-step reaction with 5 steps

1: 81.2 percent / dimethylformamide / 0.5 h / 130 - 135 °C

2: 82.46 percent / Zn, acetic acid / 1 h / 70 - 80 °C

3: 60.6 percent / POCl₃ / 6 h / Heating

4: 18 percent / POCl₃, diethylaniline / 40 h / Heating

5: 85.2 percent / ethanol / 8.5 h / Heating

With acetic acid; N,N-diethylaniline; zinc; trichlorophosphate; In ethanol; N,N-dimethyl-formamide;
DOI:10.1007/BF00758443

Reference yield:

: 65996-50-1
2,4-Dioxo-1,2,3,4-tetrahydropyrrolo<3,2-d>pyrimidine

: 114685-02-8
N²,N⁴-Bis-(4-methoxy-phenyl)-5H-pyrrolo[3,2-d]pyrimidine-2,4-diamine

Guidance literature:: Multi-step reaction with 3 steps

1: 60.6 percent / POCl₃ / 6 h / Heating

2: 18 percent / POCl₃, diethylaniline / 40 h / Heating

3: 85.2 percent / ethanol / 8.5 h / Heating

With N,N-diethylaniline; trichlorophosphate; In ethanol;
DOI:10.1007/BF00758443