5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole

C17H14FNOS — CID 118152375

IUPAC5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole
SMILESCOc1cccc(-c2nc(C)c(-c3ccc(F)cc3)s2)c1
InChIInChI=1S/C17H14FNOS/c1-11-16(12-6-8-14(18)9-7-12)21-17(19-11)13-4-3-5-15(10-13)20-2/h3-10H,1-2H3
InChIKeyQVFMYQRRZNNBSJ-UHFFFAOYSA-N
MW299.37 g/mol
LogP4.93
Rot. Bonds3

About 5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole

5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole (PubChem CID 118152375) has the molecular formula C17H14FNOS and a molecular weight of 299.37 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole.

Molecular Properties

Compound Name5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole
PubChem CID118152375
Molecular FormulaC17H14FNOS
Molecular Weight299.37 g/mol
Exact Mass299.08
IUPAC Name5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole
SMILESCOc1cccc(-c2nc(C)c(-c3ccc(F)cc3)s2)c1
InChIInChI=1S/C17H14FNOS/c1-11-16(12-6-8-14(18)9-7-12)21-17(19-11)13-4-3-5-15(10-13)20-2/h3-10H,1-2H3
InChIKeyQVFMYQRRZNNBSJ-UHFFFAOYSA-N
XLogP4.93
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[5-(4-fluorophenyl)-4-methyl-1,3-thiazol-2-yl]aniline
CID 114832647
2,5-bis(4-fluorophenyl)-4-methyl-1,3-thiazole
CID 118149754
5-methoxy-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole
CID 116887585
2-(3,4-dimethylphenyl)-5-(4-fluorophenyl)-4-methyl-1,3-thiazole
CID 118149736
N-(4-fluorophenyl)-2-[6-[2-(3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]pyridazin-3-yl]sulfanylacetamide
CID 18562631
1-[2-(3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]propan-2-one
CID 82302253
2-(4-fluorophenyl)-5-methoxy-4-methyl-1,3-thiazole
CID 116887509
2-(dimethylamino)-1-[2-(3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethanone
CID 143281589
2-(2-methoxyphenyl)-4-methyl-5-phenyl-1,3-thiazole
CID 8965022
3-(4-fluorophenyl)-5-(3-methoxyphenyl)-1,2,4-oxadiazole
CID 6459125
2-(2,3-dimethoxyphenyl)-4-methyl-5-phenyl-1,3-thiazole
CID 39902669
5-(4-fluorophenyl)-2-(2-iodo-4-methylphenyl)-4-methyl-1,3-thiazole
CID 163416847

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole?
The IUPAC name of 5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole (CID 118152375) is 5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole.
What is the SMILES notation for 5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole?
The canonical SMILES for 5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole is COc1cccc(-c2nc(C)c(-c3ccc(F)cc3)s2)c1.
What is the InChIKey of 5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole?
The InChIKey is QVFMYQRRZNNBSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNOS/c1-11-16(12-6-8-14(18)9-7-12)21-17(19-11)13-4-3-5-15(10-13)20-2/h3-10H,1-2H3.
What are the key properties of 5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole?
5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole has a molecular weight of 299.37 g/mol, XLogP of 4.93, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-2-(3-methoxyphenyl)-4-methyl-1,3-thiazole is sourced from PubChem (CID 118152375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).