2-(3,4-dimethoxyphenoxy)-1,3-thiazole

C11H11NO3S — CID 141204086

IUPAC2-(3,4-dimethoxyphenoxy)-1,3-thiazole
SMILESCOc1ccc(Oc2nccs2)cc1OC
InChIInChI=1S/C11H11NO3S/c1-13-9-4-3-8(7-10(9)14-2)15-11-12-5-6-16-11/h3-7H,1-2H3
InChIKeyYYJRDLWDUWOGEZ-UHFFFAOYSA-N
MW237.28 g/mol
LogP2.95
Rot. Bonds4

About 2-(3,4-dimethoxyphenoxy)-1,3-thiazole

2-(3,4-dimethoxyphenoxy)-1,3-thiazole (PubChem CID 141204086) has the molecular formula C11H11NO3S and a molecular weight of 237.28 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenoxy)-1,3-thiazole.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenoxy)-1,3-thiazole
PubChem CID141204086
Molecular FormulaC11H11NO3S
Molecular Weight237.28 g/mol
Exact Mass237.05
IUPAC Name2-(3,4-dimethoxyphenoxy)-1,3-thiazole
SMILESCOc1ccc(Oc2nccs2)cc1OC
InChIInChI=1S/C11H11NO3S/c1-13-9-4-3-8(7-10(9)14-2)15-11-12-5-6-16-11/h3-7H,1-2H3
InChIKeyYYJRDLWDUWOGEZ-UHFFFAOYSA-N
XLogP2.95
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.28
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,6-dimethoxyphenoxy)-1,3-thiazole
CID 141204146
4-(1,3-thiazol-2-yloxy)benzene-1,2-diamine
CID 21482771
2-[3,4-bis(trifluoromethyl)phenoxy]-1,3-thiazole
CID 173078203
2-(4-propoxyphenoxy)-1,3-thiazole
CID 175814412
2-(3-propan-2-ylphenoxy)-1,3-thiazole
CID 177129402
2-[3-chloro-4-(6-propan-2-ylnaphthalen-2-yl)oxyphenoxy]-1,3-thiazole
CID 91458393
potassium;hydride;7-(1,3-thiazol-2-yloxy)chromen-2-one
CID 173089643
4-(1,3-thiazol-2-yloxy)benzenecarboximidamide
CID 57451678
1,2-dimethoxy-4-(5-methoxy-2-methylphenoxy)benzene
CID 123959246
3-(1,3-thiazol-2-yloxy)naphthalen-2-ol
CID 60870488
4-methyl-2-(1,3-thiazol-2-yloxy)aniline
CID 43364080
2-[(2-methyl-3-pyridinyl)oxy]-1,3-thiazole
CID 155798528

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenoxy)-1,3-thiazole?
The IUPAC name of 2-(3,4-dimethoxyphenoxy)-1,3-thiazole (CID 141204086) is 2-(3,4-dimethoxyphenoxy)-1,3-thiazole.
What is the SMILES notation for 2-(3,4-dimethoxyphenoxy)-1,3-thiazole?
The canonical SMILES for 2-(3,4-dimethoxyphenoxy)-1,3-thiazole is COc1ccc(Oc2nccs2)cc1OC.
What is the InChIKey of 2-(3,4-dimethoxyphenoxy)-1,3-thiazole?
The InChIKey is YYJRDLWDUWOGEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3S/c1-13-9-4-3-8(7-10(9)14-2)15-11-12-5-6-16-11/h3-7H,1-2H3.
What are the key properties of 2-(3,4-dimethoxyphenoxy)-1,3-thiazole?
2-(3,4-dimethoxyphenoxy)-1,3-thiazole has a molecular weight of 237.28 g/mol, XLogP of 2.95, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenoxy)-1,3-thiazole is sourced from PubChem (CID 141204086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).