2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole

C26H20N4 — CID 175205519

IUPAC2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole
SMILESc1ccc(C(=C(c2ccccc2)n2ccnc2-c2ncc[nH]2)c2ccccc2)cc1
InChIInChI=1S/C26H20N4/c1-4-10-20(11-5-1)23(21-12-6-2-7-13-21)24(22-14-8-3-9-15-22)30-19-18-29-26(30)25-27-16-17-28-25/h1-19H,(H,27,28)
InChIKeySVKVJEFEGIXLGR-UHFFFAOYSA-N
MW388.47 g/mol
LogP5.74
Rot. Bonds5

About 2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole

2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole (PubChem CID 175205519) has the molecular formula C26H20N4 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole.

Molecular Properties

Compound Name2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole
PubChem CID175205519
Molecular FormulaC26H20N4
Molecular Weight388.47 g/mol
Exact Mass388.17
IUPAC Name2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole
SMILESc1ccc(C(=C(c2ccccc2)n2ccnc2-c2ncc[nH]2)c2ccccc2)cc1
InChIInChI=1S/C26H20N4/c1-4-10-20(11-5-1)23(21-12-6-2-7-13-21)24(22-14-8-3-9-15-22)30-19-18-29-26(30)25-27-16-17-28-25/h1-19H,(H,27,28)
InChIKeySVKVJEFEGIXLGR-UHFFFAOYSA-N
XLogP5.74
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.47
LogP ≤ 55.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole?
The IUPAC name of 2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole (CID 175205519) is 2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole.
What is the SMILES notation for 2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole?
The canonical SMILES for 2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole is c1ccc(C(=C(c2ccccc2)n2ccnc2-c2ncc[nH]2)c2ccccc2)cc1.
What is the InChIKey of 2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole?
The InChIKey is SVKVJEFEGIXLGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N4/c1-4-10-20(11-5-1)23(21-12-6-2-7-13-21)24(22-14-8-3-9-15-22)30-19-18-29-26(30)25-27-16-17-28-25/h1-19H,(H,27,28).
What are the key properties of 2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole?
2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole has a molecular weight of 388.47 g/mol, XLogP of 5.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole is sourced from PubChem (CID 175205519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).