[1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone

C24H19FN2O3 — CID 67429375

IUPAC[1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone
SMILESCOc1ccccc1C(=O)c1cn(-c2cccc(-c3cccc(F)c3OC)c2)cn1
InChIInChI=1S/C24H19FN2O3/c1-29-22-12-4-3-9-19(22)23(28)21-14-27(15-26-21)17-8-5-7-16(13-17)18-10-6-11-20(25)24(18)30-2/h3-15H,1-2H3
InChIKeyIOOFANPCRJMORN-UHFFFAOYSA-N
MW402.43 g/mol
LogP4.93
Rot. Bonds6

About [1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone

[1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone (PubChem CID 67429375) has the molecular formula C24H19FN2O3 and a molecular weight of 402.43 g/mol. Its IUPAC name is [1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone.

Molecular Properties

Compound Name[1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone
PubChem CID67429375
Molecular FormulaC24H19FN2O3
Molecular Weight402.43 g/mol
Exact Mass402.14
IUPAC Name[1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone
SMILESCOc1ccccc1C(=O)c1cn(-c2cccc(-c3cccc(F)c3OC)c2)cn1
InChIInChI=1S/C24H19FN2O3/c1-29-22-12-4-3-9-19(22)23(28)21-14-27(15-26-21)17-8-5-7-16(13-17)18-10-6-11-20(25)24(18)30-2/h3-15H,1-2H3
InChIKeyIOOFANPCRJMORN-UHFFFAOYSA-N
XLogP4.93
TPSA53.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.43
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone?
The IUPAC name of [1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone (CID 67429375) is [1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone.
What is the SMILES notation for [1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone?
The canonical SMILES for [1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone is COc1ccccc1C(=O)c1cn(-c2cccc(-c3cccc(F)c3OC)c2)cn1.
What is the InChIKey of [1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone?
The InChIKey is IOOFANPCRJMORN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19FN2O3/c1-29-22-12-4-3-9-19(22)23(28)21-14-27(15-26-21)17-8-5-7-16(13-17)18-10-6-11-20(25)24(18)30-2/h3-15H,1-2H3.
What are the key properties of [1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone?
[1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone has a molecular weight of 402.43 g/mol, XLogP of 4.93, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[3-(3-fluoro-2-methoxyphenyl)phenyl]imidazol-4-yl]-(2-methoxyphenyl)methanone is sourced from PubChem (CID 67429375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).