1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol

C15H12BrNO2S — CID 79819695

IUPAC1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol
SMILESOC(Cc1nc(-c2ccccc2)cs1)c1ccc(Br)o1
InChIInChI=1S/C15H12BrNO2S/c16-14-7-6-13(19-14)12(18)8-15-17-11(9-20-15)10-4-2-1-3-5-10/h1-7,9,12,18H,8H2
InChIKeyWYWFPGCSBRYXHS-UHFFFAOYSA-N
MW350.24 g/mol
LogP4.44
Rot. Bonds4

About 1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol

1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol (PubChem CID 79819695) has the molecular formula C15H12BrNO2S and a molecular weight of 350.24 g/mol. Its IUPAC name is 1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol
PubChem CID79819695
Molecular FormulaC15H12BrNO2S
Molecular Weight350.24 g/mol
Exact Mass348.98
IUPAC Name1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol
SMILESOC(Cc1nc(-c2ccccc2)cs1)c1ccc(Br)o1
InChIInChI=1S/C15H12BrNO2S/c16-14-7-6-13(19-14)12(18)8-15-17-11(9-20-15)10-4-2-1-3-5-10/h1-7,9,12,18H,8H2
InChIKeyWYWFPGCSBRYXHS-UHFFFAOYSA-N
XLogP4.44
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.24
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol with MolForge

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

Launch Full Analysis

Related Compounds

1-(5-bromofuran-2-yl)-N-methyl-2-(4-phenyl-1,3-thiazol-2-yl)ethanamine
CID 105006690
1-(furan-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol
CID 79820082
1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanone
CID 115781573
4-methyl-1-(4-phenyl-1,3-thiazol-2-yl)pentane-2,3-diol
CID 103456577
1-cyclopropyl-2-(4-phenyl-1,3-thiazol-2-yl)ethanol
CID 79819550
1-(dimethylamino)-3-(4-phenyl-1,3-thiazol-2-yl)propan-2-ol
CID 79820116
1-(2-bromofuran-3-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanamine
CID 106858077
1-(4-ethylthiadiazol-5-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol
CID 105110978
1-(1-methylpyrazol-4-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol
CID 79819696
2-fluoro-3-(4-phenyl-1,3-thiazol-2-yl)propanoic acid
CID 79817950
1-(5-bromothiophen-3-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanamine
CID 105164416
3-methoxy-3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)butan-2-ol
CID 79820192

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol?
The IUPAC name of 1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol (CID 79819695) is 1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol.
What is the SMILES notation for 1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol?
The canonical SMILES for 1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol is OC(Cc1nc(-c2ccccc2)cs1)c1ccc(Br)o1.
What is the InChIKey of 1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol?
The InChIKey is WYWFPGCSBRYXHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrNO2S/c16-14-7-6-13(19-14)12(18)8-15-17-11(9-20-15)10-4-2-1-3-5-10/h1-7,9,12,18H,8H2.
What are the key properties of 1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol?
1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol has a molecular weight of 350.24 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromofuran-2-yl)-2-(4-phenyl-1,3-thiazol-2-yl)ethanol is sourced from PubChem (CID 79819695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).