(5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol

C11H7Br2FOS — CID 79742828

IUPAC(5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol
SMILESOC(c1cc(Br)cs1)c1cc(Br)ccc1F
InChIInChI=1S/C11H7Br2FOS/c12-6-1-2-9(14)8(3-6)11(15)10-4-7(13)5-16-10/h1-5,11,15H
InChIKeyAHCFLCFJHWGRQY-UHFFFAOYSA-N
MW366.05 g/mol
LogP4.49
Rot. Bonds2

About (5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol

(5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol (PubChem CID 79742828) has the molecular formula C11H7Br2FOS and a molecular weight of 366.05 g/mol. Its IUPAC name is (5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol.

Molecular Properties

Compound Name(5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol
PubChem CID79742828
Molecular FormulaC11H7Br2FOS
Molecular Weight366.05 g/mol
Exact Mass363.86
IUPAC Name(5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol
SMILESOC(c1cc(Br)cs1)c1cc(Br)ccc1F
InChIInChI=1S/C11H7Br2FOS/c12-6-1-2-9(14)8(3-6)11(15)10-4-7(13)5-16-10/h1-5,11,15H
InChIKeyAHCFLCFJHWGRQY-UHFFFAOYSA-N
XLogP4.49
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.05
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol?
The IUPAC name of (5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol (CID 79742828) is (5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol.
What is the SMILES notation for (5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol?
The canonical SMILES for (5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol is OC(c1cc(Br)cs1)c1cc(Br)ccc1F.
What is the InChIKey of (5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol?
The InChIKey is AHCFLCFJHWGRQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Br2FOS/c12-6-1-2-9(14)8(3-6)11(15)10-4-7(13)5-16-10/h1-5,11,15H.
What are the key properties of (5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol?
(5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol has a molecular weight of 366.05 g/mol, XLogP of 4.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-2-fluorophenyl)-(4-bromothiophen-2-yl)methanol is sourced from PubChem (CID 79742828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).