2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole

C18H16F2N2O2 — CID 56863534

IUPAC2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole
SMILESCOc1ccc(Cn2ccnc2-c2ccc(OC)c(F)c2F)cc1
InChIInChI=1S/C18H16F2N2O2/c1-23-13-5-3-12(4-6-13)11-22-10-9-21-18(22)14-7-8-15(24-2)17(20)16(14)19/h3-10H,11H2,1-2H3
InChIKeyOAXVNXKSNUGZKG-UHFFFAOYSA-N
MW330.33 g/mol
LogP3.89
Rot. Bonds5

About 2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole

2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole (PubChem CID 56863534) has the molecular formula C18H16F2N2O2 and a molecular weight of 330.33 g/mol. Its IUPAC name is 2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole.

Molecular Properties

Compound Name2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole
PubChem CID56863534
Molecular FormulaC18H16F2N2O2
Molecular Weight330.33 g/mol
Exact Mass330.12
IUPAC Name2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole
SMILESCOc1ccc(Cn2ccnc2-c2ccc(OC)c(F)c2F)cc1
InChIInChI=1S/C18H16F2N2O2/c1-23-13-5-3-12(4-6-13)11-22-10-9-21-18(22)14-7-8-15(24-2)17(20)16(14)19/h3-10H,11H2,1-2H3
InChIKeyOAXVNXKSNUGZKG-UHFFFAOYSA-N
XLogP3.89
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.33
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline
CID 50981223
1-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]-6,11-dihydrobenzo[b]quinolizin-5-ium
CID 19047437
[4-[[2-[(4-methoxyphenyl)methyl]imidazol-1-yl]methyl]phenyl]methanamine
CID 82557940
4-[[2-(2-methoxyphenyl)imidazol-1-yl]methyl]benzoic acid
CID 82560557
1-[(4-methoxy-3-methylphenyl)methyl]-2-methylimidazole
CID 82078786
2-(2,5-dimethoxyphenyl)-1-methylimidazole
CID 82079235
[4-[[2-(2,4-difluorophenyl)imidazol-1-yl]methyl]phenyl]methanamine
CID 82559863
1-[(4-methoxyphenyl)methyl]imidazole-2-carbonitrile;5-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]-2H-tetrazole
CID 157459150
1-[(3-bromo-4-fluorophenyl)methyl]-2-(3-methoxyphenyl)imidazole
CID 82562089
1-[(2-chlorophenyl)methyl]-2-(5-methoxy-2-phenylphenyl)imidazole
CID 90791888
1-[2-chloro-3-fluoro-6-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]pyrazole
CID 175481138
2-ethyl-1-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]butan-1-amine
CID 68594273

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole?
The IUPAC name of 2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole (CID 56863534) is 2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole.
What is the SMILES notation for 2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole?
The canonical SMILES for 2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole is COc1ccc(Cn2ccnc2-c2ccc(OC)c(F)c2F)cc1.
What is the InChIKey of 2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole?
The InChIKey is OAXVNXKSNUGZKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16F2N2O2/c1-23-13-5-3-12(4-6-13)11-22-10-9-21-18(22)14-7-8-15(24-2)17(20)16(14)19/h3-10H,11H2,1-2H3.
What are the key properties of 2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole?
2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole has a molecular weight of 330.33 g/mol, XLogP of 3.89, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole is sourced from PubChem (CID 56863534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).