1,2,4,5-tetraphenylimidazole

C27H20N2 — CID 3098021

IUPAC1,2,4,5-tetraphenylimidazole
SMILESc1ccc(-c2nc(-c3ccccc3)n(-c3ccccc3)c2-c2ccccc2)cc1
InChIInChI=1S/C27H20N2/c1-5-13-21(14-6-1)25-26(22-15-7-2-8-16-22)29(24-19-11-4-12-20-24)27(28-25)23-17-9-3-10-18-23/h1-20H
InChIKeyNTMHHCYWWRIYIP-UHFFFAOYSA-N
MW372.47 g/mol
LogP6.87
Rot. Bonds4

About 1,2,4,5-tetraphenylimidazole

1,2,4,5-tetraphenylimidazole (PubChem CID 3098021) has the molecular formula C27H20N2 and a molecular weight of 372.47 g/mol. Its IUPAC name is 1,2,4,5-tetraphenylimidazole.

Molecular Properties

Compound Name1,2,4,5-tetraphenylimidazole
PubChem CID3098021
Molecular FormulaC27H20N2
Molecular Weight372.47 g/mol
Exact Mass372.16
IUPAC Name1,2,4,5-tetraphenylimidazole
SMILESc1ccc(-c2nc(-c3ccccc3)n(-c3ccccc3)c2-c2ccccc2)cc1
InChIInChI=1S/C27H20N2/c1-5-13-21(14-6-1)25-26(22-15-7-2-8-16-22)29(24-19-11-4-12-20-24)27(28-25)23-17-9-3-10-18-23/h1-20H
InChIKeyNTMHHCYWWRIYIP-UHFFFAOYSA-N
XLogP6.87
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.47
LogP ≤ 56.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2,4,5-tetraphenylimidazole?
The IUPAC name of 1,2,4,5-tetraphenylimidazole (CID 3098021) is 1,2,4,5-tetraphenylimidazole.
What is the SMILES notation for 1,2,4,5-tetraphenylimidazole?
The canonical SMILES for 1,2,4,5-tetraphenylimidazole is c1ccc(-c2nc(-c3ccccc3)n(-c3ccccc3)c2-c2ccccc2)cc1.
What is the InChIKey of 1,2,4,5-tetraphenylimidazole?
The InChIKey is NTMHHCYWWRIYIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H20N2/c1-5-13-21(14-6-1)25-26(22-15-7-2-8-16-22)29(24-19-11-4-12-20-24)27(28-25)23-17-9-3-10-18-23/h1-20H.
What are the key properties of 1,2,4,5-tetraphenylimidazole?
1,2,4,5-tetraphenylimidazole has a molecular weight of 372.47 g/mol, XLogP of 6.87, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,4,5-tetraphenylimidazole is sourced from PubChem (CID 3098021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).