[2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol

C14H11BrN2OS — CID 63813270

IUPAC[2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol
SMILESOCc1c(Sc2ccccc2Br)nc2ccccn12
InChIInChI=1S/C14H11BrN2OS/c15-10-5-1-2-6-12(10)19-14-11(9-18)17-8-4-3-7-13(17)16-14/h1-8,18H,9H2
InChIKeyJEXXORSMUAYDLT-UHFFFAOYSA-N
MW335.23 g/mol
LogP3.74
Rot. Bonds3

About [2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol

[2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol (PubChem CID 63813270) has the molecular formula C14H11BrN2OS and a molecular weight of 335.23 g/mol. Its IUPAC name is [2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol.

Molecular Properties

Compound Name[2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol
PubChem CID63813270
Molecular FormulaC14H11BrN2OS
Molecular Weight335.23 g/mol
Exact Mass333.98
IUPAC Name[2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol
SMILESOCc1c(Sc2ccccc2Br)nc2ccccn12
InChIInChI=1S/C14H11BrN2OS/c15-10-5-1-2-6-12(10)19-14-11(9-18)17-8-4-3-7-13(17)16-14/h1-8,18H,9H2
InChIKeyJEXXORSMUAYDLT-UHFFFAOYSA-N
XLogP3.74
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.23
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(2-fluorophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol
CID 63813667
[2-(2,4-dimethylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol
CID 63812601
(2-pyrimidin-4-ylsulfanylimidazo[1,2-a]pyridin-3-yl)methanol
CID 63835259
[2-[(4,6-dimethyl-2-pyridinyl)sulfanyl]imidazo[1,2-a]pyridin-3-yl]methanol
CID 102926184
3-[3-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]sulfanyl-4-methyl-1H-1,2,4-triazol-5-one
CID 63835596
(2-cyclohexylsulfanylimidazo[1,2-a]pyridin-3-yl)methanol
CID 63835845
[2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol
CID 79333805
N-[[2-(2-chlorophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methyl]ethanamine
CID 63806480
[2-(2-nitrophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanamine
CID 63807650
methyl 3-[3-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]sulfanylpropanoate
CID 63835303
[2-(cyclopentylmethylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol
CID 63835629
1-[2-(2-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine
CID 63818822

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol?
The IUPAC name of [2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol (CID 63813270) is [2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol.
What is the SMILES notation for [2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol?
The canonical SMILES for [2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol is OCc1c(Sc2ccccc2Br)nc2ccccn12.
What is the InChIKey of [2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol?
The InChIKey is JEXXORSMUAYDLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrN2OS/c15-10-5-1-2-6-12(10)19-14-11(9-18)17-8-4-3-7-13(17)16-14/h1-8,18H,9H2.
What are the key properties of [2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol?
[2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol has a molecular weight of 335.23 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol is sourced from PubChem (CID 63813270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).