5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole

C10H7F2NS — CID 69481821

IUPAC5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole
SMILESCc1ncsc1-c1ccc(F)cc1F
InChIInChI=1S/C10H7F2NS/c1-6-10(14-5-13-6)8-3-2-7(11)4-9(8)12/h2-5H,1H3
InChIKeyYWCVVJSUMVGWFO-UHFFFAOYSA-N
MW211.24 g/mol
LogP3.40
Rot. Bonds1

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

5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole (PubChem CID 69481821) has the molecular formula C10H7F2NS and a molecular weight of 211.24 g/mol. Its IUPAC name is 5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole.

Molecular Properties

Compound Name5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole
PubChem CID69481821
Molecular FormulaC10H7F2NS
Molecular Weight211.24 g/mol
Exact Mass211.03
IUPAC Name5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole
SMILESCc1ncsc1-c1ccc(F)cc1F
InChIInChI=1S/C10H7F2NS/c1-6-10(14-5-13-6)8-3-2-7(11)4-9(8)12/h2-5H,1H3
InChIKeyYWCVVJSUMVGWFO-UHFFFAOYSA-N
XLogP3.40
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole?
The IUPAC name of 5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole (CID 69481821) is 5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole.
What is the SMILES notation for 5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole?
The canonical SMILES for 5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole is Cc1ncsc1-c1ccc(F)cc1F.
What is the InChIKey of 5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole?
The InChIKey is YWCVVJSUMVGWFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F2NS/c1-6-10(14-5-13-6)8-3-2-7(11)4-9(8)12/h2-5H,1H3.
What are the key properties of 5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole?
5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole has a molecular weight of 211.24 g/mol, XLogP of 3.40, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-difluorophenyl)-4-methyl-1,3-thiazole is sourced from PubChem (CID 69481821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).