2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol

C11H11NO3S — CID 116889764

IUPAC2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol
SMILESCOc1ccc(-c2nc(O)cs2)c(OC)c1
InChIInChI=1S/C11H11NO3S/c1-14-7-3-4-8(9(5-7)15-2)11-12-10(13)6-16-11/h3-6,13H,1-2H3
InChIKeyJROGPHMMLLJJLQ-UHFFFAOYSA-N
MW237.28 g/mol
LogP2.53
Rot. Bonds3

About 2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol

2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol (PubChem CID 116889764) has the molecular formula C11H11NO3S and a molecular weight of 237.28 g/mol. Its IUPAC name is 2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol.

Molecular Properties

Compound Name2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol
PubChem CID116889764
Molecular FormulaC11H11NO3S
Molecular Weight237.28 g/mol
Exact Mass237.05
IUPAC Name2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol
SMILESCOc1ccc(-c2nc(O)cs2)c(OC)c1
InChIInChI=1S/C11H11NO3S/c1-14-7-3-4-8(9(5-7)15-2)11-12-10(13)6-16-11/h3-6,13H,1-2H3
InChIKeyJROGPHMMLLJJLQ-UHFFFAOYSA-N
XLogP2.53
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.28
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2,4-dimethoxyphenyl)-2-pyridin-4-yl-1,3-thiazole
CID 23408094
[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]azanide
CID 161351760
2-(4-methoxy-3-methylphenyl)-1,3-thiazol-4-ol
CID 116889737
2-(2,4-dimethoxyphenyl)-3,5-dimethoxyphenol
CID 165177874
2-(2,5-dimethoxyphenyl)-4-methyl-1,3-thiazole
CID 82083376
4-(2,4-dimethoxyphenyl)-2-pyrazin-2-yl-1,3-thiazole
CID 60529099
[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl pyrrolidine-1-carbodithioate
CID 34967643
3,5-ditert-butyl-2,6-bis(2,4-dimethoxyphenyl)phenol
CID 10435212
[2-(2,5-dimethoxyphenyl)-1,3-thiazol-4-yl]methanol
CID 39354147
3-amino-2-(2,4-dimethoxyphenyl)phenol;hydrochloride
CID 22173838
2-(2,4-dimethoxyphenyl)-5-nitro-1,3-benzothiazole
CID 23085740
2-[[2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1,3-benzothiazole
CID 34965167

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol?
The IUPAC name of 2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol (CID 116889764) is 2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol.
What is the SMILES notation for 2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol?
The canonical SMILES for 2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol is COc1ccc(-c2nc(O)cs2)c(OC)c1.
What is the InChIKey of 2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol?
The InChIKey is JROGPHMMLLJJLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3S/c1-14-7-3-4-8(9(5-7)15-2)11-12-10(13)6-16-11/h3-6,13H,1-2H3.
What are the key properties of 2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol?
2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol has a molecular weight of 237.28 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxyphenyl)-1,3-thiazol-4-ol is sourced from PubChem (CID 116889764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).