1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol

C10H10BrNOS2 — CID 115822500

IUPAC1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol
SMILESCc1cc(C(O)Cc2nccs2)sc1Br
InChIInChI=1S/C10H10BrNOS2/c1-6-4-8(15-10(6)11)7(13)5-9-12-2-3-14-9/h2-4,7,13H,5H2,1H3
InChIKeyDXFJFVNCDGYAKR-UHFFFAOYSA-N
MW304.23 g/mol
LogP3.55
Rot. Bonds3

About 1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol

1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol (PubChem CID 115822500) has the molecular formula C10H10BrNOS2 and a molecular weight of 304.23 g/mol. Its IUPAC name is 1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol
PubChem CID115822500
Molecular FormulaC10H10BrNOS2
Molecular Weight304.23 g/mol
Exact Mass302.94
IUPAC Name1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol
SMILESCc1cc(C(O)Cc2nccs2)sc1Br
InChIInChI=1S/C10H10BrNOS2/c1-6-4-8(15-10(6)11)7(13)5-9-12-2-3-14-9/h2-4,7,13H,5H2,1H3
InChIKeyDXFJFVNCDGYAKR-UHFFFAOYSA-N
XLogP3.55
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.23
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-bromo-4-methylthiophen-2-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol
CID 115824159
1-(5-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol
CID 79824094
1-(5-bromo-4-methylthiophen-2-yl)-2-(3-methylphenyl)ethanol
CID 79996774
1-(5-bromo-4-methylthiophen-2-yl)-2-(1-methylpyrazol-3-yl)ethanol
CID 115828712
1-(4-chlorothiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol
CID 79825207
1-(2-methyl-4-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol
CID 106756289
1-(5-bromo-4-methylthiophen-2-yl)-2-(3-fluorophenyl)ethanol
CID 79996332
1-(5-bromo-4-methylthiophen-2-yl)-2-(5-chloro-1,3-dimethylpyrazol-4-yl)ethanol
CID 115832380
2-(4-bromo-2-fluorophenyl)-1-(5-bromo-4-methylthiophen-2-yl)ethanol
CID 115788463
1-(2,3-dimethylphenyl)-2-(1,3-thiazol-2-yl)ethanol
CID 79825091
1-(5-bromo-4-methylthiophen-2-yl)-4-methoxybutan-1-ol
CID 115839544
1-(5-bromo-4-methylthiophen-2-yl)pent-4-yn-1-ol
CID 115799398

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol?
The IUPAC name of 1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol (CID 115822500) is 1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol.
What is the SMILES notation for 1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol?
The canonical SMILES for 1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol is Cc1cc(C(O)Cc2nccs2)sc1Br.
What is the InChIKey of 1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol?
The InChIKey is DXFJFVNCDGYAKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrNOS2/c1-6-4-8(15-10(6)11)7(13)5-9-12-2-3-14-9/h2-4,7,13H,5H2,1H3.
What are the key properties of 1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol?
1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol has a molecular weight of 304.23 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-4-methylthiophen-2-yl)-2-(1,3-thiazol-2-yl)ethanol is sourced from PubChem (CID 115822500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).