4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole

C20H18N2O5 — CID 4881297

IUPAC4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole
SMILESCOc1cc(-c2nc(-c3ccco3)c(-c3ccco3)[nH]2)cc(OC)c1OC
InChIInChI=1S/C20H18N2O5/c1-23-15-10-12(11-16(24-2)19(15)25-3)20-21-17(13-6-4-8-26-13)18(22-20)14-7-5-9-27-14/h4-11H,1-3H3,(H,21,22)
InChIKeyMZXXLPCRJGZHAL-UHFFFAOYSA-N
MW366.37 g/mol
LogP4.62
Rot. Bonds6

About 4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole

4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole (PubChem CID 4881297) has the molecular formula C20H18N2O5 and a molecular weight of 366.37 g/mol. Its IUPAC name is 4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole.

Molecular Properties

Compound Name4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole
PubChem CID4881297
Molecular FormulaC20H18N2O5
Molecular Weight366.37 g/mol
Exact Mass366.12
IUPAC Name4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole
SMILESCOc1cc(-c2nc(-c3ccco3)c(-c3ccco3)[nH]2)cc(OC)c1OC
InChIInChI=1S/C20H18N2O5/c1-23-15-10-12(11-16(24-2)19(15)25-3)20-21-17(13-6-4-8-26-13)18(22-20)14-7-5-9-27-14/h4-11H,1-3H3,(H,21,22)
InChIKeyMZXXLPCRJGZHAL-UHFFFAOYSA-N
XLogP4.62
TPSA82.65 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.37
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole?
The IUPAC name of 4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole (CID 4881297) is 4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole.
What is the SMILES notation for 4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole?
The canonical SMILES for 4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole is COc1cc(-c2nc(-c3ccco3)c(-c3ccco3)[nH]2)cc(OC)c1OC.
What is the InChIKey of 4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole?
The InChIKey is MZXXLPCRJGZHAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O5/c1-23-15-10-12(11-16(24-2)19(15)25-3)20-21-17(13-6-4-8-26-13)18(22-20)14-7-5-9-27-14/h4-11H,1-3H3,(H,21,22).
What are the key properties of 4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole?
4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole has a molecular weight of 366.37 g/mol, XLogP of 4.62, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(furan-2-yl)-2-(3,4,5-trimethoxyphenyl)-1H-imidazole is sourced from PubChem (CID 4881297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).