4-(4-methoxyphenoxy)-1,3-thiazole

C10H9NO2S — CID 91530747

IUPAC4-(4-methoxyphenoxy)-1,3-thiazole
SMILESCOc1ccc(Oc2cscn2)cc1
InChIInChI=1S/C10H9NO2S/c1-12-8-2-4-9(5-3-8)13-10-6-14-7-11-10/h2-7H,1H3
InChIKeyJLUJQSLMCBVDFC-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.94
Rot. Bonds3

About 4-(4-methoxyphenoxy)-1,3-thiazole

4-(4-methoxyphenoxy)-1,3-thiazole (PubChem CID 91530747) has the molecular formula C10H9NO2S and a molecular weight of 207.25 g/mol. Its IUPAC name is 4-(4-methoxyphenoxy)-1,3-thiazole.

Molecular Properties

Compound Name4-(4-methoxyphenoxy)-1,3-thiazole
PubChem CID91530747
Molecular FormulaC10H9NO2S
Molecular Weight207.25 g/mol
Exact Mass207.04
IUPAC Name4-(4-methoxyphenoxy)-1,3-thiazole
SMILESCOc1ccc(Oc2cscn2)cc1
InChIInChI=1S/C10H9NO2S/c1-12-8-2-4-9(5-3-8)13-10-6-14-7-11-10/h2-7H,1H3
InChIKeyJLUJQSLMCBVDFC-UHFFFAOYSA-N
XLogP2.94
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenoxy)-1,3-thiazole?
The IUPAC name of 4-(4-methoxyphenoxy)-1,3-thiazole (CID 91530747) is 4-(4-methoxyphenoxy)-1,3-thiazole.
What is the SMILES notation for 4-(4-methoxyphenoxy)-1,3-thiazole?
The canonical SMILES for 4-(4-methoxyphenoxy)-1,3-thiazole is COc1ccc(Oc2cscn2)cc1.
What is the InChIKey of 4-(4-methoxyphenoxy)-1,3-thiazole?
The InChIKey is JLUJQSLMCBVDFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO2S/c1-12-8-2-4-9(5-3-8)13-10-6-14-7-11-10/h2-7H,1H3.
What are the key properties of 4-(4-methoxyphenoxy)-1,3-thiazole?
4-(4-methoxyphenoxy)-1,3-thiazole has a molecular weight of 207.25 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenoxy)-1,3-thiazole is sourced from PubChem (CID 91530747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).