2-bromo-4-(2-bromophenyl)-6-methylpyrimidine

C11H8Br2N2 — CID 116897341

IUPAC2-bromo-4-(2-bromophenyl)-6-methylpyrimidine
SMILESCc1cc(-c2ccccc2Br)nc(Br)n1
InChIInChI=1S/C11H8Br2N2/c1-7-6-10(15-11(13)14-7)8-4-2-3-5-9(8)12/h2-6H,1H3
InChIKeyUIGLVDGFQBKZEU-UHFFFAOYSA-N
MW328.01 g/mol
LogP3.98
Rot. Bonds1

About 2-bromo-4-(2-bromophenyl)-6-methylpyrimidine

2-bromo-4-(2-bromophenyl)-6-methylpyrimidine (PubChem CID 116897341) has the molecular formula C11H8Br2N2 and a molecular weight of 328.01 g/mol. Its IUPAC name is 2-bromo-4-(2-bromophenyl)-6-methylpyrimidine.

Molecular Properties

Compound Name2-bromo-4-(2-bromophenyl)-6-methylpyrimidine
PubChem CID116897341
Molecular FormulaC11H8Br2N2
Molecular Weight328.01 g/mol
Exact Mass325.91
IUPAC Name2-bromo-4-(2-bromophenyl)-6-methylpyrimidine
SMILESCc1cc(-c2ccccc2Br)nc(Br)n1
InChIInChI=1S/C11H8Br2N2/c1-7-6-10(15-11(13)14-7)8-4-2-3-5-9(8)12/h2-6H,1H3
InChIKeyUIGLVDGFQBKZEU-UHFFFAOYSA-N
XLogP3.98
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.01
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-(2-bromophenyl)-6-methylpyrimidine?
The IUPAC name of 2-bromo-4-(2-bromophenyl)-6-methylpyrimidine (CID 116897341) is 2-bromo-4-(2-bromophenyl)-6-methylpyrimidine.
What is the SMILES notation for 2-bromo-4-(2-bromophenyl)-6-methylpyrimidine?
The canonical SMILES for 2-bromo-4-(2-bromophenyl)-6-methylpyrimidine is Cc1cc(-c2ccccc2Br)nc(Br)n1.
What is the InChIKey of 2-bromo-4-(2-bromophenyl)-6-methylpyrimidine?
The InChIKey is UIGLVDGFQBKZEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Br2N2/c1-7-6-10(15-11(13)14-7)8-4-2-3-5-9(8)12/h2-6H,1H3.
What are the key properties of 2-bromo-4-(2-bromophenyl)-6-methylpyrimidine?
2-bromo-4-(2-bromophenyl)-6-methylpyrimidine has a molecular weight of 328.01 g/mol, XLogP of 3.98, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-(2-bromophenyl)-6-methylpyrimidine is sourced from PubChem (CID 116897341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).