Methyl 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxybenzoate

Base Information

Chemical Name:Methyl 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxybenzoate
CAS No.:55687-40-6
Molecular Formula:C15H18N4O4
Molecular Weight:318.3278
Hs Code.:
DSSTox Substance ID:DTXSID00877830
Nikkaji Number:J1.575.077D
Wikidata:Q82859718
ChEMBL ID:CHEMBL367765

Synonyms:55687-40-6;Methyl 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxybenzoate;BRN 0840115;Methyl alpha-(2,4-diamino-5-pyrimidinyl)-2,6-dimethoxy-p-toluate;Benzoic acid, 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxy-, methyl ester;CHEMBL367765;SCHEMBL11852992;DTXSID00877830;24-NH2PYRIMIDN,5(35MEO-4-CO2ME)BENZYL

Suppliers and Price of Methyl 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxybenzoate

Supply Marketing:

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

Manufacturers and distributors:

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Total 1 raw suppliers

Chemical Property of Methyl 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxybenzoate

Chemical Property:

Vapor Pressure:2.65E-14mmHg at 25°C
Boiling Point:598.9°C at 760 mmHg
Flash Point:316°C
PSA：124.04000
Density:1.295g/cm³
LogP:0.89580
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:318.13280507
Heavy Atom Count:23
Complexity:384

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC(=CC(=C1C(=O)OC)OC)CC2=CN=C(N=C2N)N

Technology Process of Methyl 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxybenzoate

There total 6 articles about Methyl 4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxybenzoate 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: 86.0%

: 50-01-1
guanidine hydrochloride

: 55687-39-3
methyl 4-(3-anilino-2-cyanoallyl)-2,6-dimethoxybenzoate

: 55687-40-6
methyl α-(2,4-diamino-5-pyrimidinyl)-2,6-dimethoxy-p-toluate

Guidance literature:: With sodium methylate; In ethanol; for 40h; Heating;

Reference yield:

: 55720-60-0
4-(3,3-dimethoxy-2-cyanopropyl)-2,6-dimethoxybenzoic acid methyl ester

: 33187-98-3
3,5-dimethoxy-4-(methoxycarbonyl)benzaldehyde

: 50-01-1
guanidine hydrochloride

: 107-13-1,25014-41-9
acrylonitrile

: 55687-40-6
methyl α-(2,4-diamino-5-pyrimidinyl)-2,6-dimethoxy-p-toluate

Guidance literature:: In methanol; water; acetic acid;

Reference yield:

: 33187-98-3
3,5-dimethoxy-4-(methoxycarbonyl)benzaldehyde

: 55687-40-6
methyl α-(2,4-diamino-5-pyrimidinyl)-2,6-dimethoxy-p-toluate

Guidance literature:: Multi-step reaction with 3 steps

1: 81 percent / sodium methylate / dimethylformamide / 0.25 h / 75 °C

2: 95 percent / propan-2-ol / 0.5 h / Heating

3: 86 percent / sodium methylate / ethanol / 40 h / Heating

With sodium methylate; In ethanol; N,N-dimethyl-formamide; isopropyl alcohol;