1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole

C30H23FN2O — CID 144582835

IUPAC1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole
SMILESCC(C)c1cccc(-c2cccc3c2oc2ccccc23)c1-n1ccnc1-c1ccc(F)cc1
InChIInChI=1S/C30H23FN2O/c1-19(2)22-8-5-9-24(26-11-6-10-25-23-7-3-4-12-27(23)34-29(25)26)28(22)33-18-17-32-30(33)20-13-15-21(31)16-14-20/h3-19H,1-2H3
InChIKeySOORXRJTSRSUDO-UHFFFAOYSA-N
MW446.53 g/mol
LogP8.37
Rot. Bonds4

About 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole

1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole (PubChem CID 144582835) has the molecular formula C30H23FN2O and a molecular weight of 446.53 g/mol. Its IUPAC name is 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole.

Molecular Properties

Compound Name1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole
PubChem CID144582835
Molecular FormulaC30H23FN2O
Molecular Weight446.53 g/mol
Exact Mass446.18
IUPAC Name1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole
SMILESCC(C)c1cccc(-c2cccc3c2oc2ccccc23)c1-n1ccnc1-c1ccc(F)cc1
InChIInChI=1S/C30H23FN2O/c1-19(2)22-8-5-9-24(26-11-6-10-25-23-7-3-4-12-27(23)34-29(25)26)28(22)33-18-17-32-30(33)20-13-15-21(31)16-14-20/h3-19H,1-2H3
InChIKeySOORXRJTSRSUDO-UHFFFAOYSA-N
XLogP8.37
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms34
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.53
LogP ≤ 58.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole?
The IUPAC name of 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole (CID 144582835) is 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole.
What is the SMILES notation for 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole?
The canonical SMILES for 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole is CC(C)c1cccc(-c2cccc3c2oc2ccccc23)c1-n1ccnc1-c1ccc(F)cc1.
What is the InChIKey of 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole?
The InChIKey is SOORXRJTSRSUDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H23FN2O/c1-19(2)22-8-5-9-24(26-11-6-10-25-23-7-3-4-12-27(23)34-29(25)26)28(22)33-18-17-32-30(33)20-13-15-21(31)16-14-20/h3-19H,1-2H3.
What are the key properties of 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole?
1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole has a molecular weight of 446.53 g/mol, XLogP of 8.37, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-dibenzofuran-4-yl-6-propan-2-ylphenyl)-2-(4-fluorophenyl)imidazole is sourced from PubChem (CID 144582835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).