(5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone

C14H9Br2FO2 — CID 103394193

IUPAC(5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone
SMILESCOc1cc(F)c(Br)cc1C(=O)c1ccccc1Br
InChIInChI=1S/C14H9Br2FO2/c1-19-13-7-12(17)11(16)6-9(13)14(18)8-4-2-3-5-10(8)15/h2-7H,1H3
InChIKeyVUVYPISDNAHNTR-UHFFFAOYSA-N
MW388.03 g/mol
LogP4.59
Rot. Bonds3

About (5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone

(5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone (PubChem CID 103394193) has the molecular formula C14H9Br2FO2 and a molecular weight of 388.03 g/mol. Its IUPAC name is (5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone.

Molecular Properties

Compound Name(5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone
PubChem CID103394193
Molecular FormulaC14H9Br2FO2
Molecular Weight388.03 g/mol
Exact Mass385.90
IUPAC Name(5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone
SMILESCOc1cc(F)c(Br)cc1C(=O)c1ccccc1Br
InChIInChI=1S/C14H9Br2FO2/c1-19-13-7-12(17)11(16)6-9(13)14(18)8-4-2-3-5-10(8)15/h2-7H,1H3
InChIKeyVUVYPISDNAHNTR-UHFFFAOYSA-N
XLogP4.59
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.03
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-bromophenyl)-(2-fluoro-4,5-dimethoxyphenyl)methanone
CID 62866561
(5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromo-6-fluorophenyl)methanone
CID 103394058
(5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromofuran-3-yl)methanone
CID 106851427
(5-bromo-4-fluoro-2-methoxyphenyl)-(4-chlorophenyl)methanone
CID 103394161
(5-bromo-4-fluoro-2-methoxyphenyl)-(5-bromofuran-2-yl)methanone
CID 103394164
(3-bromo-2-fluorophenyl)-(2-fluoro-4,5-dimethoxyphenyl)methanone
CID 107949862
(2-bromo-5-methoxyphenyl)-(2-bromophenyl)methanone
CID 138970439
(4-bromo-2,5-dimethoxyphenyl)-(2-bromo-3-fluorophenyl)methanone
CID 105056401
1-(5-bromo-4-fluoro-2-methoxyphenyl)-2,2,2-trifluoroethanone
CID 103394263
1-(5-bromo-4-fluoro-2-methoxyphenyl)-2-(2,6-difluorophenyl)ethanone
CID 103394235
(5-bromo-2-methoxy-4-methylphenyl)-(2-fluoro-4-methoxyphenyl)methanone
CID 102882282
(4-amino-3-chlorophenyl)-(5-bromo-4-fluoro-2-methoxyphenyl)methanone
CID 103396687

Frequently Asked Questions

What is the IUPAC name of (5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone?
The IUPAC name of (5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone (CID 103394193) is (5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone.
What is the SMILES notation for (5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone?
The canonical SMILES for (5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone is COc1cc(F)c(Br)cc1C(=O)c1ccccc1Br.
What is the InChIKey of (5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone?
The InChIKey is VUVYPISDNAHNTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Br2FO2/c1-19-13-7-12(17)11(16)6-9(13)14(18)8-4-2-3-5-10(8)15/h2-7H,1H3.
What are the key properties of (5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone?
(5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone has a molecular weight of 388.03 g/mol, XLogP of 4.59, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-4-fluoro-2-methoxyphenyl)-(2-bromophenyl)methanone is sourced from PubChem (CID 103394193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).