(5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol

C8H6BrNO2S — CID 131101510

IUPAC(5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol
SMILESOC(c1ccsn1)c1ccc(Br)o1
InChIInChI=1S/C8H6BrNO2S/c9-7-2-1-6(12-7)8(11)5-3-4-13-10-5/h1-4,8,11H
InChIKeyMUEABXDCZHHABR-UHFFFAOYSA-N
MW260.11 g/mol
LogP2.58
Rot. Bonds2

About (5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol

(5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol (PubChem CID 131101510) has the molecular formula C8H6BrNO2S and a molecular weight of 260.11 g/mol. Its IUPAC name is (5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol.

Molecular Properties

Compound Name(5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol
PubChem CID131101510
Molecular FormulaC8H6BrNO2S
Molecular Weight260.11 g/mol
Exact Mass258.93
IUPAC Name(5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol
SMILESOC(c1ccsn1)c1ccc(Br)o1
InChIInChI=1S/C8H6BrNO2S/c9-7-2-1-6(12-7)8(11)5-3-4-13-10-5/h1-4,8,11H
InChIKeyMUEABXDCZHHABR-UHFFFAOYSA-N
XLogP2.58
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.11
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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1-(5-bromofuran-2-yl)prop-2-yn-1-ol
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(5-bromofuran-2-yl)-[2-(trifluoromethyl)phenyl]methanol
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1-(5-bromofuran-2-yl)-2-methylprop-2-en-1-ol
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3-(1-chloroethyl)-1,2-thiazole
CID 130920926
methyl 5-[(5-bromofuran-2-yl)-hydroxymethyl]furan-2-carboxylate
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Frequently Asked Questions

What is the IUPAC name of (5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol?
The IUPAC name of (5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol (CID 131101510) is (5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol.
What is the SMILES notation for (5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol?
The canonical SMILES for (5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol is OC(c1ccsn1)c1ccc(Br)o1.
What is the InChIKey of (5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol?
The InChIKey is MUEABXDCZHHABR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6BrNO2S/c9-7-2-1-6(12-7)8(11)5-3-4-13-10-5/h1-4,8,11H.
What are the key properties of (5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol?
(5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol has a molecular weight of 260.11 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromofuran-2-yl)-(1,2-thiazol-3-yl)methanol is sourced from PubChem (CID 131101510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).