4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole

C17H15NO2S — CID 2441960

IUPAC4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole
SMILESCOc1ccc(-c2csc(-c3ccccc3)n2)c(OC)c1
InChIInChI=1S/C17H15NO2S/c1-19-13-8-9-14(16(10-13)20-2)15-11-21-17(18-15)12-6-4-3-5-7-12/h3-11H,1-2H3
InChIKeyUYAPYZIXBMPWKE-UHFFFAOYSA-N
MW297.38 g/mol
LogP4.49
Rot. Bonds4

About 4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole

4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole (PubChem CID 2441960) has the molecular formula C17H15NO2S and a molecular weight of 297.38 g/mol. Its IUPAC name is 4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole.

Molecular Properties

Compound Name4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole
PubChem CID2441960
Molecular FormulaC17H15NO2S
Molecular Weight297.38 g/mol
Exact Mass297.08
IUPAC Name4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole
SMILESCOc1ccc(-c2csc(-c3ccccc3)n2)c(OC)c1
InChIInChI=1S/C17H15NO2S/c1-19-13-8-9-14(16(10-13)20-2)15-11-21-17(18-15)12-6-4-3-5-7-12/h3-11H,1-2H3
InChIKeyUYAPYZIXBMPWKE-UHFFFAOYSA-N
XLogP4.49
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole?
The IUPAC name of 4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole (CID 2441960) is 4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole.
What is the SMILES notation for 4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole?
The canonical SMILES for 4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole is COc1ccc(-c2csc(-c3ccccc3)n2)c(OC)c1.
What is the InChIKey of 4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole?
The InChIKey is UYAPYZIXBMPWKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2S/c1-19-13-8-9-14(16(10-13)20-2)15-11-21-17(18-15)12-6-4-3-5-7-12/h3-11H,1-2H3.
What are the key properties of 4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole?
4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole has a molecular weight of 297.38 g/mol, XLogP of 4.49, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dimethoxyphenyl)-2-phenyl-1,3-thiazole is sourced from PubChem (CID 2441960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).