2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole

C17H11FN2S2 — CID 15998611

IUPAC2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole
SMILESFc1ccccc1-c1nc(-c2cccs2)c(-c2cccs2)[nH]1
InChIInChI=1S/C17H11FN2S2/c18-12-6-2-1-5-11(12)17-19-15(13-7-3-9-21-13)16(20-17)14-8-4-10-22-14/h1-10H,(H,19,20)
InChIKeyMUGOTUWNNWWCFI-UHFFFAOYSA-N
MW326.42 g/mol
LogP5.67
Rot. Bonds3

About 2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole

2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole (PubChem CID 15998611) has the molecular formula C17H11FN2S2 and a molecular weight of 326.42 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole.

Molecular Properties

Compound Name2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole
PubChem CID15998611
Molecular FormulaC17H11FN2S2
Molecular Weight326.42 g/mol
Exact Mass326.03
IUPAC Name2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole
SMILESFc1ccccc1-c1nc(-c2cccs2)c(-c2cccs2)[nH]1
InChIInChI=1S/C17H11FN2S2/c18-12-6-2-1-5-11(12)17-19-15(13-7-3-9-21-13)16(20-17)14-8-4-10-22-14/h1-10H,(H,19,20)
InChIKeyMUGOTUWNNWWCFI-UHFFFAOYSA-N
XLogP5.67
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.42
LogP ≤ 55.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,5-diphenyl-2-(2-thienyl)-1H-imidazole
CID 767504
7-Methyl-2-(thiophen-2'-yl)-1H-benzo[d]imidazole (11)
CID 60646299
4-[4,5-Bis(thiophen-2-YL)-1H-imidazol-2-YL]-N,N-dimethylaniline
CID 10247401
4,5-bis(4-fluorophenyl)-2-(thiophen-2-yl)-1H-imidazole
CID 921225
2-(3-nitrophenyl)-4,5-di-2-thienyl-1H-imidazole
CID 1327610
5-(2-ethylsulfanylphenyl)-2-thiophen-3-yl-1H-imidazole
CID 90643461
2-[5-(5-carbamimidoylthiophen-2-yl)thiophen-2-yl]-3H-benzimidazole-5-carboximidamide
CID 145955805
4-(4-methylsulfonylphenyl)-5-thiophen-2-yl-2-(trifluoromethyl)-1H-imidazole
CID 10156111
5-(4-methylsulfonylphenyl)-4-thiophen-3-yl-2-(trifluoromethyl)-1H-imidazole
CID 18463790
4-phenyl-2-(3-thienyl)-1H-imidazole
CID 20277973
(E)-2-(1H-benzimidazol-2-yl)-3-(5-thiophen-2-ylthiophen-2-yl)prop-2-enenitrile
CID 50943150
2-(3-methyl-2-thienyl)-4,5-diphenyl-1H-imidazole
CID 685908

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole?
The IUPAC name of 2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole (CID 15998611) is 2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole.
What is the SMILES notation for 2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole?
The canonical SMILES for 2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole is Fc1ccccc1-c1nc(-c2cccs2)c(-c2cccs2)[nH]1.
What is the InChIKey of 2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole?
The InChIKey is MUGOTUWNNWWCFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11FN2S2/c18-12-6-2-1-5-11(12)17-19-15(13-7-3-9-21-13)16(20-17)14-8-4-10-22-14/h1-10H,(H,19,20).
What are the key properties of 2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole?
2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole has a molecular weight of 326.42 g/mol, XLogP of 5.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-4,5-dithiophen-2-yl-1H-imidazole is sourced from PubChem (CID 15998611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).