5-Bromo-6-methyluracil - CAS 15018-56-1

Catalog:	BB010497
Product Name:	5-Bromo-6-methyluracil
CAS:	15018-56-1
Synonyms:	5-bromo-6-methyl-1H-pyrimidine-2,4-dione; 5-bromo-6-methyl-1H-pyrimidine-2,4-dione

Technical Data

Patents

Computed Properties

IUPAC Name:	5-bromo-6-methyl-1H-pyrimidine-2,4-dione
Description:	5-Bromo-6-methyluracil (CAS# 15018-56-1) is a useful research chemical.
Molecular Weight:	205.01
Molecular Formula:	C5H5BrN2O2
Canonical SMILES:	CC1=C(C(=O)NC(=O)N1)Br
InChI:	InChI=1S/C5H5BrN2O2/c1-2-3(6)4(9)8-5(10)7-2/h1H3,(H2,7,8,9,10)
InChI Key:	HEAXNUZNYDEXFG-UHFFFAOYSA-N
Density:	1.78 g/cm³
LogP:	0.13410

Publication Number	Title	Priority Date
WO-2020108590-A1	Pyrimidine and five-membered nitrogen heterocycle derivative, preparation method therefor, and medical uses thereof	20181130
TW-202039498-A	Pyrimidine five-membered nitrogen heterocyclic derivatives, a preparation method thereof and pharmaceutical use thereof	20181130
CN-113272303-A	Pyrimido five-membered nitrogen heterocyclic derivative, preparation method and application thereof in medicine	20181130
EP-3889153-A1	Pyrimidine and five-membered nitrogen heterocycle derivative, preparation method therefor, and medical uses thereof	20181130
KR-20210097144-A	Pyrimidine and 5-membered nitrogen heterocycle derivatives, methods for their preparation, and medical uses thereof	20181130

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Complexity:	234
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	203.95344
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	203.95344
Rotatable Bond Count:	0
Topological Polar Surface Area:	58.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3