4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole

C11H9F2NO2S — CID 116967804

IUPAC4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole
SMILESCOc1nc(-c2cc(F)c(OC)cc2F)cs1
InChIInChI=1S/C11H9F2NO2S/c1-15-10-4-7(12)6(3-8(10)13)9-5-17-11(14-9)16-2/h3-5H,1-2H3
InChIKeyLPTTXQZVABLRQM-UHFFFAOYSA-N
MW257.26 g/mol
LogP3.11
Rot. Bonds3

About 4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole

4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole (PubChem CID 116967804) has the molecular formula C11H9F2NO2S and a molecular weight of 257.26 g/mol. Its IUPAC name is 4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole.

Molecular Properties

Compound Name4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole
PubChem CID116967804
Molecular FormulaC11H9F2NO2S
Molecular Weight257.26 g/mol
Exact Mass257.03
IUPAC Name4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole
SMILESCOc1nc(-c2cc(F)c(OC)cc2F)cs1
InChIInChI=1S/C11H9F2NO2S/c1-15-10-4-7(12)6(3-8(10)13)9-5-17-11(14-9)16-2/h3-5H,1-2H3
InChIKeyLPTTXQZVABLRQM-UHFFFAOYSA-N
XLogP3.11
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.26
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,5-difluoro-4-methoxyphenyl)-1,3-thiazole-4-thiol
CID 116889694
4-(2,4-dimethylphenyl)-2-methoxy-1,3-thiazole
CID 116967726
5-(2,5-difluoro-4-methoxyphenyl)-N-methyl-1H-pyrazol-3-amine
CID 116827288
2-(2,5-difluoro-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-amine
CID 116864535
2-[4-(2,5-difluoro-4-methoxyphenyl)pyrimidin-2-yl]ethanamine
CID 116897723
4-(2,5-difluoro-4-methoxyphenyl)pyrimidine-2-carboxylic acid
CID 116899779
4-(3-fluoro-4-methoxyphenyl)-2-propan-2-yl-1,3-thiazole
CID 59333191
[3-(2,5-difluoro-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methanamine
CID 117354397
ethane;2-methoxy-4-(4-methylphenyl)-1,3-thiazole
CID 145078481
6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine
CID 116854306
4-(2-methoxy-4,5-dimethylphenyl)-2-methyl-1,3-thiazole
CID 82129096
5-(2,5-difluoro-4-methoxyphenyl)-N-methylpyrimidin-2-amine
CID 116977036

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole?
The IUPAC name of 4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole (CID 116967804) is 4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole.
What is the SMILES notation for 4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole?
The canonical SMILES for 4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole is COc1nc(-c2cc(F)c(OC)cc2F)cs1.
What is the InChIKey of 4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole?
The InChIKey is LPTTXQZVABLRQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F2NO2S/c1-15-10-4-7(12)6(3-8(10)13)9-5-17-11(14-9)16-2/h3-5H,1-2H3.
What are the key properties of 4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole?
4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole has a molecular weight of 257.26 g/mol, XLogP of 3.11, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-difluoro-4-methoxyphenyl)-2-methoxy-1,3-thiazole is sourced from PubChem (CID 116967804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).