4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole

C15H11FN2OS — CID 31263109

IUPAC4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole
SMILESCOc1ccc(-c2csc(-c3ccncc3)n2)cc1F
InChIInChI=1S/C15H11FN2OS/c1-19-14-3-2-11(8-12(14)16)13-9-20-15(18-13)10-4-6-17-7-5-10/h2-9H,1H3
InChIKeyBVLJQBSYXSNYGK-UHFFFAOYSA-N
MW286.33 g/mol
LogP4.02
Rot. Bonds3

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

4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole (PubChem CID 31263109) has the molecular formula C15H11FN2OS and a molecular weight of 286.33 g/mol. Its IUPAC name is 4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole
PubChem CID31263109
Molecular FormulaC15H11FN2OS
Molecular Weight286.33 g/mol
Exact Mass286.06
IUPAC Name4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole
SMILESCOc1ccc(-c2csc(-c3ccncc3)n2)cc1F
InChIInChI=1S/C15H11FN2OS/c1-19-14-3-2-11(8-12(14)16)13-9-20-15(18-13)10-4-6-17-7-5-10/h2-9H,1H3
InChIKeyBVLJQBSYXSNYGK-UHFFFAOYSA-N
XLogP4.02
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3-fluoro-4-methoxyphenyl)-2-(2-methylsulfanyl-4-pyridinyl)-1,3-thiazole
CID 103597527
2-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-4-thiophen-2-yl-1,3-thiazole
CID 46245962
4-(3-fluoro-4-methoxyphenyl)-2-propan-2-yl-1,3-thiazole
CID 59333191
N-[3-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]phenyl]cyclopropanecarboxamide
CID 9173855
4-(3-fluoro-4-methoxyphenyl)-1,3-thiazole-2-carbothioamide
CID 73253852
4-(2,4-dimethoxyphenyl)-2-pyridin-4-yl-1,3-thiazole
CID 23408094
1-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylethanamine
CID 4613320
2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-(3,4-dimethoxyphenyl)-1,3-thiazole
CID 46339236
4-(5-fluoro-2-methoxyphenyl)-2-(4-methylphenyl)-1,3-thiazole
CID 8963152
4-(4-methoxy-3-methylphenyl)-2-pyridin-3-yl-1,3-thiazole
CID 885223
2-(3,4-dimethoxyphenyl)-4-phenyl-1,3-thiazole
CID 1147052
2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-(4-methylphenyl)-1,3-thiazole
CID 46339235

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole?
The IUPAC name of 4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole (CID 31263109) is 4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole.
What is the SMILES notation for 4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole?
The canonical SMILES for 4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole is COc1ccc(-c2csc(-c3ccncc3)n2)cc1F.
What is the InChIKey of 4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole?
The InChIKey is BVLJQBSYXSNYGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2OS/c1-19-14-3-2-11(8-12(14)16)13-9-20-15(18-13)10-4-6-17-7-5-10/h2-9H,1H3.
What are the key properties of 4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole?
4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole has a molecular weight of 286.33 g/mol, XLogP of 4.02, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluoro-4-methoxyphenyl)-2-pyridin-4-yl-1,3-thiazole is sourced from PubChem (CID 31263109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).