4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole

C15H13NOS2 — CID 35618487

IUPAC4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole
SMILESCOc1ccccc1-c1csc(-c2sccc2C)n1
InChIInChI=1S/C15H13NOS2/c1-10-7-8-18-14(10)15-16-12(9-19-15)11-5-3-4-6-13(11)17-2/h3-9H,1-2H3
InChIKeyIKTLQIXHOXFZKH-UHFFFAOYSA-N
MW287.41 g/mol
LogP4.86
Rot. Bonds3

About 4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole

4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole (PubChem CID 35618487) has the molecular formula C15H13NOS2 and a molecular weight of 287.41 g/mol. Its IUPAC name is 4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole.

Molecular Properties

Compound Name4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole
PubChem CID35618487
Molecular FormulaC15H13NOS2
Molecular Weight287.41 g/mol
Exact Mass287.04
IUPAC Name4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole
SMILESCOc1ccccc1-c1csc(-c2sccc2C)n1
InChIInChI=1S/C15H13NOS2/c1-10-7-8-18-14(10)15-16-12(9-19-15)11-5-3-4-6-13(11)17-2/h3-9H,1-2H3
InChIKeyIKTLQIXHOXFZKH-UHFFFAOYSA-N
XLogP4.86
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole?
The IUPAC name of 4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole (CID 35618487) is 4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole.
What is the SMILES notation for 4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole?
The canonical SMILES for 4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole is COc1ccccc1-c1csc(-c2sccc2C)n1.
What is the InChIKey of 4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole?
The InChIKey is IKTLQIXHOXFZKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NOS2/c1-10-7-8-18-14(10)15-16-12(9-19-15)11-5-3-4-6-13(11)17-2/h3-9H,1-2H3.
What are the key properties of 4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole?
4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole has a molecular weight of 287.41 g/mol, XLogP of 4.86, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenyl)-2-(3-methylthiophen-2-yl)-1,3-thiazole is sourced from PubChem (CID 35618487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).