5-Bromo-2-chloro-4-methoxypyrimidine - CAS 57054-92-9

Catalog:	BB029571
Product Name:	5-Bromo-2-chloro-4-methoxypyrimidine
CAS:	57054-92-9
Synonyms:	5-bromo-2-chloro-4-methoxypyrimidine; 5-bromo-2-chloro-4-methoxypyrimidine

Technical Data

Patents

Computed Properties

IUPAC Name:	5-bromo-2-chloro-4-methoxypyrimidine
Description:	5-Bromo-2-chloro-4-methoxypyrimidine (CAS# 57054-92-9) is a useful research chemical.
Molecular Weight:	223.46
Molecular Formula:	C5H4BrClN2O
Canonical SMILES:	COC1=NC(=NC=C1Br)Cl
InChI:	InChI=1S/C5H4BrClN2O/c1-10-4-3(6)2-8-5(7)9-4/h2H,1H3
InChI Key:	ZPPORMCRNCNFGX-UHFFFAOYSA-N
Boiling Point:	323.6 °C at 760 mmHg
Density:	1.745 g/cm³
LogP:	1.90110

Publication Number	Title	Priority Date
CN-113348170-A	Biphenyl derivative inhibitor, preparation method and application thereof	20200103
WO-2021136354-A1	Biphenyl derivative inhibitor, preparation method therefor and use thereof	20200103
WO-2021025976-A1	Substituted cyclopropyl-2,2'-bipyrimidinyl compounds, analogues thereof, and methods using same	20190802
WO-2021011796-A1	Inhibitors of cyclin-dependent kinases	20190717
WO-2020131597-A1	Pyrimidone derivatives as selective cytotoxic agents against hiv infected cells	20181218

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Complexity:	116
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	221.91955
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	221.91955
Rotatable Bond Count:	1
Topological Polar Surface Area:	35
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2