4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole

C14H17NO2S — CID 116970071

IUPAC4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole
SMILESCCc1nc(-c2cc(OC)c(OC)cc2C)cs1
InChIInChI=1S/C14H17NO2S/c1-5-14-15-11(8-18-14)10-7-13(17-4)12(16-3)6-9(10)2/h6-8H,5H2,1-4H3
InChIKeyQOXCFZMEQBALHJ-UHFFFAOYSA-N
MW263.36 g/mol
LogP3.70
Rot. Bonds4

About 4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole

4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole (PubChem CID 116970071) has the molecular formula C14H17NO2S and a molecular weight of 263.36 g/mol. Its IUPAC name is 4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole.

Molecular Properties

Compound Name4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole
PubChem CID116970071
Molecular FormulaC14H17NO2S
Molecular Weight263.36 g/mol
Exact Mass263.10
IUPAC Name4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole
SMILESCCc1nc(-c2cc(OC)c(OC)cc2C)cs1
InChIInChI=1S/C14H17NO2S/c1-5-14-15-11(8-18-14)10-7-13(17-4)12(16-3)6-9(10)2/h6-8H,5H2,1-4H3
InChIKeyQOXCFZMEQBALHJ-UHFFFAOYSA-N
XLogP3.70
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazole
CID 116970066
4-(4-methoxy-2,5-dimethylphenyl)-2-methyl-1,3-thiazole
CID 82129098
2-(bromomethyl)-4-(2-methoxy-4,5-dimethylphenyl)-1,3-thiazole
CID 116970291
4-(2-methoxy-4,5-dimethylphenyl)-2-methyl-1,3-thiazole
CID 82129096
[4-(4-ethoxy-2,5-dimethylphenyl)-1,3-thiazol-2-yl]methanamine
CID 3941656
1-[4-(4-ethoxy-2,5-dimethylphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
CID 4309550
2-(bromomethyl)-4-(5-ethyl-2-methoxyphenyl)-1,3-thiazole
CID 116970303
2-(bromomethyl)-4-(4-methoxy-2,3,6-trimethylphenyl)-1,3-thiazole
CID 116970374
1-[4-(4-ethoxy-2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
CID 4022868
4-(2,4-dimethylphenyl)-2-(methoxymethyl)-1,3-thiazole
CID 116969941
2-[4-(5-ethyl-2-methoxyphenyl)-1,3-thiazol-2-yl]acetaldehyde
CID 116968837
2-[4-(4-methoxy-3-methylphenyl)-1,3-thiazol-2-yl]ethanethiol
CID 116965970

Frequently Asked Questions

What is the IUPAC name of 4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole?
The IUPAC name of 4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole (CID 116970071) is 4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole.
What is the SMILES notation for 4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole?
The canonical SMILES for 4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole is CCc1nc(-c2cc(OC)c(OC)cc2C)cs1.
What is the InChIKey of 4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole?
The InChIKey is QOXCFZMEQBALHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2S/c1-5-14-15-11(8-18-14)10-7-13(17-4)12(16-3)6-9(10)2/h6-8H,5H2,1-4H3.
What are the key properties of 4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole?
4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole has a molecular weight of 263.36 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,5-dimethoxy-2-methylphenyl)-2-ethyl-1,3-thiazole is sourced from PubChem (CID 116970071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).