4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole

C12H13NO2S — CID 116967744

IUPAC4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole
SMILESCCOc1ccc(-c2csc(OC)n2)cc1
InChIInChI=1S/C12H13NO2S/c1-3-15-10-6-4-9(5-7-10)11-8-16-12(13-11)14-2/h4-8H,3H2,1-2H3
InChIKeyKEEMPZMOLFOGTD-UHFFFAOYSA-N
MW235.31 g/mol
LogP3.22
Rot. Bonds4

About 4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole

4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole (PubChem CID 116967744) has the molecular formula C12H13NO2S and a molecular weight of 235.31 g/mol. Its IUPAC name is 4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole.

Molecular Properties

Compound Name4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole
PubChem CID116967744
Molecular FormulaC12H13NO2S
Molecular Weight235.31 g/mol
Exact Mass235.07
IUPAC Name4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole
SMILESCCOc1ccc(-c2csc(OC)n2)cc1
InChIInChI=1S/C12H13NO2S/c1-3-15-10-6-4-9(5-7-10)11-8-16-12(13-11)14-2/h4-8H,3H2,1-2H3
InChIKeyKEEMPZMOLFOGTD-UHFFFAOYSA-N
XLogP3.22
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.31
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;2-methoxy-4-(4-methylphenyl)-1,3-thiazole
CID 145078481
[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]hydrazine;hydrobromide
CID 171114823
2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]ethanamine
CID 1497789
N-[[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]methyl]-2-methylpropan-2-amine
CID 62542712
N-[[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]methyl]ethanamine;hydrochloride
CID 120558378
2-chloro-1-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]ethanone
CID 83969147
4-(4-aminophenyl)-N-(4-ethoxyphenyl)-1,3-thiazol-2-amine
CID 13155729
4-(4-ethoxyphenyl)-2-methoxypyrimidine
CID 116903760
3-(4-ethoxyphenyl)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]propanamide
CID 19226097
4-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-1H-pyrazol-5-amine
CID 60650136
4-(4-ethoxyphenyl)-2-pyrrolidin-2-yl-1,3-thiazole
CID 62539820
4-(4-ethoxyphenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 29457657

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole?
The IUPAC name of 4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole (CID 116967744) is 4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole.
What is the SMILES notation for 4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole?
The canonical SMILES for 4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole is CCOc1ccc(-c2csc(OC)n2)cc1.
What is the InChIKey of 4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole?
The InChIKey is KEEMPZMOLFOGTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2S/c1-3-15-10-6-4-9(5-7-10)11-8-16-12(13-11)14-2/h4-8H,3H2,1-2H3.
What are the key properties of 4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole?
4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole has a molecular weight of 235.31 g/mol, XLogP of 3.22, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxyphenyl)-2-methoxy-1,3-thiazole is sourced from PubChem (CID 116967744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).