2,4-Bis(benzyloxy)-5-bromopyrimidine - CAS 41244-53-5
Catalog: |
BB024836 |
Product Name: |
2,4-Bis(benzyloxy)-5-bromopyrimidine |
CAS: |
41244-53-5 |
Synonyms: |
5-bromo-2,4-bis(phenylmethoxy)pyrimidine; 5-bromo-2,4-bis(phenylmethoxy)pyrimidine |
IUPAC Name: | 5-bromo-2,4-bis(phenylmethoxy)pyrimidine |
Description: | 2,4-Bis(benzyloxy)-5-bromopyrimidine (CAS# 41244-53-5) is a useful research chemical. |
Molecular Weight: | 371.23 |
Molecular Formula: | C18H15BrN2O2 |
Canonical SMILES: | C1=CC=C(C=C1)COC2=NC(=NC=C2Br)OCC3=CC=CC=C3 |
InChI: | InChI=1S/C18H15BrN2O2/c19-16-11-20-18(23-13-15-9-5-2-6-10-15)21-17(16)22-12-14-7-3-1-4-8-14/h1-11H,12-13H2 |
InChI Key: | QMPWETJGPVPWGU-UHFFFAOYSA-N |
Boiling Point: | 517.4 °C at 760 mmHg |
Density: | 1.419 g/cm3 |
LogP: | 4.39710 |
Publication Number | Title | Priority Date |
WO-2021083380-A1 | Eed inhibitor, and preparation method therefor and use thereof | 20191101 |
EP-2010523-A1 | Spirocompounds useful as modulators for dopamine d3 receptors | 20060427 |
JP-2009534442-A | Spiro compounds useful as modulators for dopamine D3 receptors | 20060427 |
JP-5179472-B2 | Spiro compounds useful as modulators for dopamine D3 receptors | 20060427 |
US-2010063078-A1 | Spirocompounds useful as modulators for dopamine d3 receptors | 20060427 |
Complexity: | 333 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 370.03169 |
Formal Charge: | 0 |
Heavy Atom Count: | 23 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 370.03169 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 44.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.5 |
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