1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol

C11H10BrNOS — CID 62652128

IUPAC1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol
SMILESCC(O)c1cnc(-c2ccc(Br)cc2)s1
InChIInChI=1S/C11H10BrNOS/c1-7(14)10-6-13-11(15-10)8-2-4-9(12)5-3-8/h2-7,14H,1H3
InChIKeyAMWYWMJSHXIUJH-UHFFFAOYSA-N
MW284.18 g/mol
LogP3.63
Rot. Bonds2

About 1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol

1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol (PubChem CID 62652128) has the molecular formula C11H10BrNOS and a molecular weight of 284.18 g/mol. Its IUPAC name is 1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol.

Molecular Properties

Compound Name1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol
PubChem CID62652128
Molecular FormulaC11H10BrNOS
Molecular Weight284.18 g/mol
Exact Mass282.97
IUPAC Name1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol
SMILESCC(O)c1cnc(-c2ccc(Br)cc2)s1
InChIInChI=1S/C11H10BrNOS/c1-7(14)10-6-13-11(15-10)8-2-4-9(12)5-3-8/h2-7,14H,1H3
InChIKeyAMWYWMJSHXIUJH-UHFFFAOYSA-N
XLogP3.63
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.18
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-Phenyl-1,3-thiazol-5-yl)methanol
CID 16495207
1-(4-Bromophenyl)-2-[methyl-[(2-methyl-1,3-thiazol-5-yl)methyl]amino]ethanol
CID 53572357
1-[2-(4-Bromophenyl)-4-methyl-1,3-thiazol-5-yl]ethan-1-ol
CID 53621255
{2-[4-(Trifluoromethyl)phenyl]-1,3-thiazol-5-yl}methanol
CID 22647407
2-[2-[4-(Trifluoromethyl)phenyl]-1,3-thiazol-5-yl]propan-2-ol
CID 22647492
1-[2-(4-Trifluoromethylphenyl)thiazol-5-yl]ethanol
CID 22647613
[2-[3-(Trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methanol
CID 46785476
1-(2-(4-Fluorophenyl)thiazol-5-yl)ethanol
CID 62651773
(2-(2-Fluorophenyl)thiazol-5-yl)methanol
CID 65576375
(2-(4-Fluorophenyl)thiazol-5-YL)methanol
CID 65576801
2,2,2-Trifluoro-1-(2-phenylthiazol-5-yl)ethanol
CID 67402697
(1R)-1-[2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]ethanol
CID 69220919

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol?
The IUPAC name of 1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol (CID 62652128) is 1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol.
What is the SMILES notation for 1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol?
The canonical SMILES for 1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol is CC(O)c1cnc(-c2ccc(Br)cc2)s1.
What is the InChIKey of 1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol?
The InChIKey is AMWYWMJSHXIUJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrNOS/c1-7(14)10-6-13-11(15-10)8-2-4-9(12)5-3-8/h2-7,14H,1H3.
What are the key properties of 1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol?
1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol has a molecular weight of 284.18 g/mol, XLogP of 3.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]ethanol is sourced from PubChem (CID 62652128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).