ChemicalBook--->CAS DataBase List--->30806-86-1

30806-86-1

30806-86-1 Structure

30806-86-1 Structure
IdentificationBack Directory
[Name]

Trimethoprim Related Compound B (25 mg) (2,4-diaminopyrimidin-5-yl)(3,4,5-trimethoxyphenyl)methanone) (AS)
[CAS]

30806-86-1
[Synonyms]

Trimethoprim EP Impurity B
Trimethoprim Keto Analogue
Trimethoprim USP Related Compound B
(2,4-Diaminopyrimidin-5-yl)-(3,4,5-
Trimethoprim Impurity 2 (Trimethoprim EP Impurity B)
(2,4-Diamino-5-pyrimidinyl)(3,4,5-trimethoxyphenyl)methanone
Methanone,(2,4-diaMino-5-pyriMidinyl)(3,4,5-triMethoxyphenyl)-
Trimethoprim EP Impurity B (Trimethoprim USP Related Compound B)
Trimethoprim Related Compound B(Secondary Standards traceble to USP)
(2,4-Diaminopyrimidin-5-yl)(3,4,5-trimethoxyphenyl)methanone (Trimethoprim Impurity)
Trimethoprim Related Compound B (2,4-diaminopyrimidin-5-yl)(3,4,5-trimethoxyphenyl)methanone) (1692527)
Trimethoprim Related Compound B (25 mg) (2,4-diaminopyrimidin-5-yl)(3,4,5-trimethoxyphenyl)methanone) (AS)
Trimethoprim EP Impurity B/Trimethoprim USP RC B/(2,4-Diaminopyrimidin-5-yl)(3,4,5-trimethoxyphenyl)methanone
[Molecular Formula]

C14H16N4O4
[MDL Number]

MFCD22666234
[MOL File]

30806-86-1.mol
[Molecular Weight]

304.3
Chemical PropertiesBack Directory
[Melting point ]

152-154 °C(Solv: benzene (71-43-2))
[Boiling point ]

616.4±65.0 °C(Predicted)
[density ]

1.319±0.06 g/cm3(Predicted)
[solubility ]

soluble in Methanol
[pka]

4.71±0.10(Predicted)
[Major Application]

pharmaceutical
[InChI]

1S/C14H16N4O4/c1-20-9-4-7(5-10(21-2)12(9)22-3)11(19)8-6-17-14(16)18-13(8)15/h4-6H,1-3H3,(H4,15,16,17,18)
[InChIKey]

GAAPPIKAFNZRLA-UHFFFAOYSA-N
[SMILES]

Nc1nc(c(cn1)C(=O)c2cc(c(c(c2)OC)OC)OC)N
Safety DataBack Directory
[WGK Germany ]

WGK 3
[HS Code ]

2933599550
[Storage Class]

6.1D - Non-combustible acute toxic Cat.3
toxic hazardous materials or hazardous materials causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Repr. 2
Hazard InformationBack Directory
[Uses]

5-(3,4,5-Trimethoxybenzoyl)-2,4-pyrimidinediamine, is a derivative of Trimethoprim (T795615), an antibacterial agent. 5-(3,4,5-Trimethoxybenzoyl)-2,4-pyrimidinediamine, is a possible potent and selective inhibitor targeting dihydrofolate reductase of C. hominis, used for the treatment of Cryptosporidiosis.
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