2-Amino-4-(4-methoxyphenyl)pyrimidine - CAS 99844-02-7
Catalog: |
BB042349 |
Product Name: |
2-Amino-4-(4-methoxyphenyl)pyrimidine |
CAS: |
99844-02-7 |
Synonyms: |
4-(4-methoxyphenyl)-2-pyrimidinamine; 4-(4-methoxyphenyl)pyrimidin-2-amine |
IUPAC Name: | 4-(4-methoxyphenyl)pyrimidin-2-amine |
Description: | 2-Amino-4-(4-methoxyphenyl)pyrimidine (CAS# 99844-02-7) is a useful research chemical. |
Molecular Weight: | 201.22 |
Molecular Formula: | C11H11N3O |
Canonical SMILES: | COC1=CC=C(C=C1)C2=NC(=NC=C2)N |
InChI: | InChI=1S/C11H11N3O/c1-15-9-4-2-8(3-5-9)10-6-7-13-11(12)14-10/h2-7H,1H3,(H2,12,13,14) |
InChI Key: | GHSMJZASRNAUBJ-UHFFFAOYSA-N |
Boiling Point: | 434 °C at 760 mmHg |
Density: | 1.201 g/cm3 |
LogP: | 2.31560 |
Publication Number | Title | Priority Date |
CN-112010844-A | Preparation method and application of N- (pyrimidine-2-yl) coumarin-7-amine derivative as protein kinase inhibitor | 20190531 |
KR-20130090144-A | Novel pyrimidine derivatives or pharmaceutically acceptable salts thereof, preparation methods thereof, and pharmaceutical compositions for the prevention or treatment of RAE receptor-related diseases comprising the same | 20120203 |
EP-2166858-A1 | Novel heterocycle compounds and uses thereof | 20070607 |
JP-2010529131-A | Novel heterocyclic compounds and uses thereof | 20070607 |
JP-2015007075-A | Novel heterocyclic compounds and uses thereof | 20070607 |
PMID | Publication Date | Title | Journal |
22483591 | 20120501 | Identification of novel isocytosine derivatives as xanthine oxidase inhibitors from a set of virtual screening hits | Bioorganic & medicinal chemistry |
Complexity: | 192 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.090211983 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.090211983 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 61 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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