4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole

C14H8F2N2S — CID 2800024

IUPAC4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole
SMILESFc1ccc(-c2csc(-c3cccnc3)n2)cc1F
InChIInChI=1S/C14H8F2N2S/c15-11-4-3-9(6-12(11)16)13-8-19-14(18-13)10-2-1-5-17-7-10/h1-8H
InChIKeyZRUNXNQWSCECCR-UHFFFAOYSA-N
MW274.30 g/mol
LogP4.15
Rot. Bonds2

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

4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole (PubChem CID 2800024) has the molecular formula C14H8F2N2S and a molecular weight of 274.30 g/mol. Its IUPAC name is 4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole
PubChem CID2800024
Molecular FormulaC14H8F2N2S
Molecular Weight274.30 g/mol
Exact Mass274.04
IUPAC Name4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole
SMILESFc1ccc(-c2csc(-c3cccnc3)n2)cc1F
InChIInChI=1S/C14H8F2N2S/c15-11-4-3-9(6-12(11)16)13-8-19-14(18-13)10-2-1-5-17-7-10/h1-8H
InChIKeyZRUNXNQWSCECCR-UHFFFAOYSA-N
XLogP4.15
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole
CID 592589
3-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]aniline
CID 43667884
[3-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenyl]methanamine
CID 63152435
2-[3-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenyl]isoindole-1,3-dione
CID 168518992
4-(4-methoxy-3-methylphenyl)-2-pyridin-3-yl-1,3-thiazole
CID 885223
4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole
CID 849786
4-(4-bromophenyl)-2-(3,4-difluorophenyl)-1,3-thiazole
CID 79839828
2,3,4-trifluoro-N-[3-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 108748572
4-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole
CID 119088487
N-methyl-4-(4-pyridin-3-yl-1,3-thiazol-2-yl)aniline
CID 116965446
4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole
CID 141340133
4-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-1H-pyrazol-5-amine
CID 60650205

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole?
The IUPAC name of 4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole (CID 2800024) is 4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole.
What is the SMILES notation for 4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole?
The canonical SMILES for 4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole is Fc1ccc(-c2csc(-c3cccnc3)n2)cc1F.
What is the InChIKey of 4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole?
The InChIKey is ZRUNXNQWSCECCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8F2N2S/c15-11-4-3-9(6-12(11)16)13-8-19-14(18-13)10-2-1-5-17-7-10/h1-8H.
What are the key properties of 4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole?
4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole has a molecular weight of 274.30 g/mol, XLogP of 4.15, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole is sourced from PubChem (CID 2800024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).