2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole

C24H17F3N2O — CID 15887232

IUPAC2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole
SMILESFC(F)(F)c1ccc(-c2ccc3oc(-c4ccccc4C4=NCCN4)cc3c2)cc1
InChIInChI=1S/C24H17F3N2O/c25-24(26,27)18-8-5-15(6-9-18)16-7-10-21-17(13-16)14-22(30-21)19-3-1-2-4-20(19)23-28-11-12-29-23/h1-10,13-14H,11-12H2,(H,28,29)
InChIKeyXYUDFZSHVCSOJQ-UHFFFAOYSA-N
MW406.41 g/mol
LogP6.14
Rot. Bonds3

About 2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole

2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole (PubChem CID 15887232) has the molecular formula C24H17F3N2O and a molecular weight of 406.41 g/mol. Its IUPAC name is 2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole
PubChem CID15887232
Molecular FormulaC24H17F3N2O
Molecular Weight406.41 g/mol
Exact Mass406.13
IUPAC Name2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole
SMILESFC(F)(F)c1ccc(-c2ccc3oc(-c4ccccc4C4=NCCN4)cc3c2)cc1
InChIInChI=1S/C24H17F3N2O/c25-24(26,27)18-8-5-15(6-9-18)16-7-10-21-17(13-16)14-22(30-21)19-3-1-2-4-20(19)23-28-11-12-29-23/h1-10,13-14H,11-12H2,(H,28,29)
InChIKeyXYUDFZSHVCSOJQ-UHFFFAOYSA-N
XLogP6.14
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.41
LogP ≤ 56.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole (CID 15887232) is 2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole is FC(F)(F)c1ccc(-c2ccc3oc(-c4ccccc4C4=NCCN4)cc3c2)cc1.
What is the InChIKey of 2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole?
The InChIKey is XYUDFZSHVCSOJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17F3N2O/c25-24(26,27)18-8-5-15(6-9-18)16-7-10-21-17(13-16)14-22(30-21)19-3-1-2-4-20(19)23-28-11-12-29-23/h1-10,13-14H,11-12H2,(H,28,29).
What are the key properties of 2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole?
2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole has a molecular weight of 406.41 g/mol, XLogP of 6.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[5-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-yl]phenyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 15887232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).