1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole

C19H16N2S — CID 164676952

IUPAC1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole
SMILESc1ccc(C2CN(c3ccccc3)C(c3ccsc3)=N2)cc1
InChIInChI=1S/C19H16N2S/c1-3-7-15(8-4-1)18-13-21(17-9-5-2-6-10-17)19(20-18)16-11-12-22-14-16/h1-12,14,18H,13H2
InChIKeyVLHQMBXTSUUGKV-UHFFFAOYSA-N
MW304.42 g/mol
LogP4.76
Rot. Bonds3

About 1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole

1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole (PubChem CID 164676952) has the molecular formula C19H16N2S and a molecular weight of 304.42 g/mol. Its IUPAC name is 1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole.

Molecular Properties

Compound Name1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole
PubChem CID164676952
Molecular FormulaC19H16N2S
Molecular Weight304.42 g/mol
Exact Mass304.10
IUPAC Name1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole
SMILESc1ccc(C2CN(c3ccccc3)C(c3ccsc3)=N2)cc1
InChIInChI=1S/C19H16N2S/c1-3-7-15(8-4-1)18-13-21(17-9-5-2-6-10-17)19(20-18)16-11-12-22-14-16/h1-12,14,18H,13H2
InChIKeyVLHQMBXTSUUGKV-UHFFFAOYSA-N
XLogP4.76
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole?
The IUPAC name of 1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole (CID 164676952) is 1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole.
What is the SMILES notation for 1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole?
The canonical SMILES for 1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole is c1ccc(C2CN(c3ccccc3)C(c3ccsc3)=N2)cc1.
What is the InChIKey of 1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole?
The InChIKey is VLHQMBXTSUUGKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2S/c1-3-7-15(8-4-1)18-13-21(17-9-5-2-6-10-17)19(20-18)16-11-12-22-14-16/h1-12,14,18H,13H2.
What are the key properties of 1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole?
1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole has a molecular weight of 304.42 g/mol, XLogP of 4.76, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-diphenyl-2-thiophen-3-yl-4,5-dihydroimidazole is sourced from PubChem (CID 164676952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).