(5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol

C15H10BrFO2 — CID 3088259

IUPAC(5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol
SMILESOC(c1ccc(F)cc1)c1cc2cc(Br)ccc2o1
InChIInChI=1S/C15H10BrFO2/c16-11-3-6-13-10(7-11)8-14(19-13)15(18)9-1-4-12(17)5-2-9/h1-8,15,18H
InChIKeyJYBPMXZSWISASV-UHFFFAOYSA-N
MW321.15 g/mol
LogP4.42
Rot. Bonds2

About (5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol

(5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol (PubChem CID 3088259) has the molecular formula C15H10BrFO2 and a molecular weight of 321.15 g/mol. Its IUPAC name is (5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol.

Molecular Properties

Compound Name(5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol
PubChem CID3088259
Molecular FormulaC15H10BrFO2
Molecular Weight321.15 g/mol
Exact Mass319.98
IUPAC Name(5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol
SMILESOC(c1ccc(F)cc1)c1cc2cc(Br)ccc2o1
InChIInChI=1S/C15H10BrFO2/c16-11-3-6-13-10(7-11)8-14(19-13)15(18)9-1-4-12(17)5-2-9/h1-8,15,18H
InChIKeyJYBPMXZSWISASV-UHFFFAOYSA-N
XLogP4.42
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.15
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol?
The IUPAC name of (5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol (CID 3088259) is (5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol.
What is the SMILES notation for (5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol?
The canonical SMILES for (5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol is OC(c1ccc(F)cc1)c1cc2cc(Br)ccc2o1.
What is the InChIKey of (5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol?
The InChIKey is JYBPMXZSWISASV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrFO2/c16-11-3-6-13-10(7-11)8-14(19-13)15(18)9-1-4-12(17)5-2-9/h1-8,15,18H.
What are the key properties of (5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol?
(5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol has a molecular weight of 321.15 g/mol, XLogP of 4.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-1-benzofuran-2-yl)-(4-fluorophenyl)methanol is sourced from PubChem (CID 3088259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).