1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione

C10H5Br2FN2O3 — CID 112599815

IUPAC1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
SMILESO=c1[nH]c(=O)n(-c2ccc(Br)cc2Br)c(O)c1F
InChIInChI=1S/C10H5Br2FN2O3/c11-4-1-2-6(5(12)3-4)15-9(17)7(13)8(16)14-10(15)18/h1-3,17H,(H,14,16,18)
InChIKeyLDKYCESLLCQHAW-UHFFFAOYSA-N
MW379.97 g/mol
LogP1.90
Rot. Bonds1

About 1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione

1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione (PubChem CID 112599815) has the molecular formula C10H5Br2FN2O3 and a molecular weight of 379.97 g/mol. Its IUPAC name is 1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione.

Molecular Properties

Compound Name1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
PubChem CID112599815
Molecular FormulaC10H5Br2FN2O3
Molecular Weight379.97 g/mol
Exact Mass377.87
IUPAC Name1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
SMILESO=c1[nH]c(=O)n(-c2ccc(Br)cc2Br)c(O)c1F
InChIInChI=1S/C10H5Br2FN2O3/c11-4-1-2-6(5(12)3-4)15-9(17)7(13)8(16)14-10(15)18/h1-3,17H,(H,14,16,18)
InChIKeyLDKYCESLLCQHAW-UHFFFAOYSA-N
XLogP1.90
TPSA75.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.97
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-bromo-2,5-difluorophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
CID 107608492
1-(4-bromo-2,3-dichlorophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
CID 107795625
1-(2-bromo-5-methoxyphenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
CID 112600912
5-fluoro-1-(2-fluoro-4-methylphenyl)-6-hydroxypyrimidine-2,4-dione
CID 112599069
5-fluoro-1-(2-fluorophenyl)-6-hydroxypyrimidine-2,4-dione
CID 112598333
1-(2,6-dibromo-4-methylphenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
CID 112599158
1-(4-bromo-2-fluorophenyl)-5-ethyl-6-hydroxypyrimidine-2,4-dione
CID 112598971
1-(3,4-difluorophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
CID 112598353
1-[4-bromo-2-(trifluoromethyl)phenyl]-6-hydroxy-5-methylpyrimidine-2,4-dione
CID 115946946
5-fluoro-1-(2-fluoro-5-methoxyphenyl)-6-hydroxypyrimidine-2,4-dione
CID 112601269
1-(2,3-dimethylphenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione
CID 112598553
1-(2-bromo-4-methylphenyl)-5-ethyl-6-hydroxypyrimidine-2,4-dione
CID 112598976

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione?
The IUPAC name of 1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione (CID 112599815) is 1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione.
What is the SMILES notation for 1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione?
The canonical SMILES for 1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione is O=c1[nH]c(=O)n(-c2ccc(Br)cc2Br)c(O)c1F.
What is the InChIKey of 1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione?
The InChIKey is LDKYCESLLCQHAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Br2FN2O3/c11-4-1-2-6(5(12)3-4)15-9(17)7(13)8(16)14-10(15)18/h1-3,17H,(H,14,16,18).
What are the key properties of 1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione?
1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione has a molecular weight of 379.97 g/mol, XLogP of 1.90, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dibromophenyl)-5-fluoro-6-hydroxypyrimidine-2,4-dione is sourced from PubChem (CID 112599815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).