4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole

C23H18F2N2O2 — CID 16666726

IUPAC4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole
SMILESCOc1ccc(F)cc1-c1cccc(-n2cnc(-c3cc(F)ccc3OC)c2)c1
InChIInChI=1S/C23H18F2N2O2/c1-28-22-8-6-16(24)11-19(22)15-4-3-5-18(10-15)27-13-21(26-14-27)20-12-17(25)7-9-23(20)29-2/h3-14H,1-2H3
InChIKeyYBKPEDQNPIDVLG-UHFFFAOYSA-N
MW392.41 g/mol
LogP5.50
Rot. Bonds5

About 4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole

4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole (PubChem CID 16666726) has the molecular formula C23H18F2N2O2 and a molecular weight of 392.41 g/mol. Its IUPAC name is 4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole.

Molecular Properties

Compound Name4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole
PubChem CID16666726
Molecular FormulaC23H18F2N2O2
Molecular Weight392.41 g/mol
Exact Mass392.13
IUPAC Name4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole
SMILESCOc1ccc(F)cc1-c1cccc(-n2cnc(-c3cc(F)ccc3OC)c2)c1
InChIInChI=1S/C23H18F2N2O2/c1-28-22-8-6-16(24)11-19(22)15-4-3-5-18(10-15)27-13-21(26-14-27)20-12-17(25)7-9-23(20)29-2/h3-14H,1-2H3
InChIKeyYBKPEDQNPIDVLG-UHFFFAOYSA-N
XLogP5.50
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.41
LogP ≤ 55.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole?
The IUPAC name of 4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole (CID 16666726) is 4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole.
What is the SMILES notation for 4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole?
The canonical SMILES for 4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole is COc1ccc(F)cc1-c1cccc(-n2cnc(-c3cc(F)ccc3OC)c2)c1.
What is the InChIKey of 4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole?
The InChIKey is YBKPEDQNPIDVLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18F2N2O2/c1-28-22-8-6-16(24)11-19(22)15-4-3-5-18(10-15)27-13-21(26-14-27)20-12-17(25)7-9-23(20)29-2/h3-14H,1-2H3.
What are the key properties of 4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole?
4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole has a molecular weight of 392.41 g/mol, XLogP of 5.50, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-fluoro-2-methoxyphenyl)-1-[3-(5-fluoro-2-methoxyphenyl)phenyl]imidazole is sourced from PubChem (CID 16666726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).