4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole

C28H24N2O2 — CID 102184325

IUPAC4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole
SMILESCOc1ccc(-n2c(-c3ccc(C)cc3)nc(-c3ccco3)c2-c2ccc(C)cc2)cc1
InChIInChI=1S/C28H24N2O2/c1-19-6-10-21(11-7-19)27-26(25-5-4-18-32-25)29-28(22-12-8-20(2)9-13-22)30(27)23-14-16-24(31-3)17-15-23/h4-18H,1-3H3
InChIKeySKSOFYCKQVHLCC-UHFFFAOYSA-N
MW420.51 g/mol
LogP7.09
Rot. Bonds5

About 4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole

4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole (PubChem CID 102184325) has the molecular formula C28H24N2O2 and a molecular weight of 420.51 g/mol. Its IUPAC name is 4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole.

Molecular Properties

Compound Name4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole
PubChem CID102184325
Molecular FormulaC28H24N2O2
Molecular Weight420.51 g/mol
Exact Mass420.18
IUPAC Name4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole
SMILESCOc1ccc(-n2c(-c3ccc(C)cc3)nc(-c3ccco3)c2-c2ccc(C)cc2)cc1
InChIInChI=1S/C28H24N2O2/c1-19-6-10-21(11-7-19)27-26(25-5-4-18-32-25)29-28(22-12-8-20(2)9-13-22)30(27)23-14-16-24(31-3)17-15-23/h4-18H,1-3H3
InChIKeySKSOFYCKQVHLCC-UHFFFAOYSA-N
XLogP7.09
TPSA40.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.51
LogP ≤ 57.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole?
The IUPAC name of 4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole (CID 102184325) is 4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole.
What is the SMILES notation for 4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole?
The canonical SMILES for 4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole is COc1ccc(-n2c(-c3ccc(C)cc3)nc(-c3ccco3)c2-c2ccc(C)cc2)cc1.
What is the InChIKey of 4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole?
The InChIKey is SKSOFYCKQVHLCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24N2O2/c1-19-6-10-21(11-7-19)27-26(25-5-4-18-32-25)29-28(22-12-8-20(2)9-13-22)30(27)23-14-16-24(31-3)17-15-23/h4-18H,1-3H3.
What are the key properties of 4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole?
4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole has a molecular weight of 420.51 g/mol, XLogP of 7.09, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole is sourced from PubChem (CID 102184325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).