2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole

C42H34N4O6 — CID 102380800

IUPAC2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole
SMILESCOc1cccc(C2=NC(c3ccco3)(n3c(-c4ccco4)nc(-c4cccc(OC)c4)c3-c3cccc(OC)c3)N=C2c2cccc(OC)c2)c1
InChIInChI=1S/C42H34N4O6/c1-47-31-15-5-11-27(23-31)37-38(28-12-6-16-32(24-28)48-2)45-42(44-37,36-20-10-22-52-36)46-40(30-14-8-18-34(26-30)50-4)39(29-13-7-17-33(25-29)49-3)43-41(46)35-19-9-21-51-35/h5-26H,1-4H3
InChIKeyPQGZAYLQORZVEB-UHFFFAOYSA-N
MW690.76 g/mol
LogP8.76
Rot. Bonds11

About 2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole

2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole (PubChem CID 102380800) has the molecular formula C42H34N4O6 and a molecular weight of 690.76 g/mol. Its IUPAC name is 2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole.

Molecular Properties

Compound Name2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole
PubChem CID102380800
Molecular FormulaC42H34N4O6
Molecular Weight690.76 g/mol
Exact Mass690.25
IUPAC Name2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole
SMILESCOc1cccc(C2=NC(c3ccco3)(n3c(-c4ccco4)nc(-c4cccc(OC)c4)c3-c3cccc(OC)c3)N=C2c2cccc(OC)c2)c1
InChIInChI=1S/C42H34N4O6/c1-47-31-15-5-11-27(23-31)37-38(28-12-6-16-32(24-28)48-2)45-42(44-37,36-20-10-22-52-36)46-40(30-14-8-18-34(26-30)50-4)39(29-13-7-17-33(25-29)49-3)43-41(46)35-19-9-21-51-35/h5-26H,1-4H3
InChIKeyPQGZAYLQORZVEB-UHFFFAOYSA-N
XLogP8.76
TPSA105.74 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds11
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500690.76
LogP ≤ 58.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

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Related Compounds

1-[4,5-diphenyl-2-(2,4,6-trimethoxyphenyl)imidazol-2-yl]-4,5-diphenyl-2-(2,4,6-trimethoxyphenyl)imidazole
CID 58709362
2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine
CID 132941107
2-(furan-2-yl)-1-methyl-4,5-diphenylimidazole
CID 15129898
2,3-bis(3-methoxyphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
CID 102200708
5-(furan-2-yl)-3-(3-methoxyphenyl)-1H-pyrazole
CID 73052635
1-(4-chlorophenyl)-3,5-bis(3-methoxyphenyl)-4-methylpyrazole
CID 19587327
3,5-bis(3-methoxyphenyl)-4-methyl-1-(4-methylphenyl)pyrazole
CID 19587307
2-(furan-2-yl)-1-[3-(3-methoxyphenoxy)propyl]benzimidazole
CID 17000191
4-(furan-2-yl)-1-(4-methoxyphenyl)-2,5-bis(4-methylphenyl)imidazole
CID 102184325
2-[4-(3-methoxyphenoxy)phenyl]furan
CID 168524914
6-(3-methoxyphenyl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80974789
4-(3-methoxyphenyl)-1-methyl-3-(2-methylfuran-3-yl)pyrazol-5-amine
CID 61262748

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole?
The IUPAC name of 2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole (CID 102380800) is 2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole.
What is the SMILES notation for 2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole?
The canonical SMILES for 2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole is COc1cccc(C2=NC(c3ccco3)(n3c(-c4ccco4)nc(-c4cccc(OC)c4)c3-c3cccc(OC)c3)N=C2c2cccc(OC)c2)c1.
What is the InChIKey of 2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole?
The InChIKey is PQGZAYLQORZVEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H34N4O6/c1-47-31-15-5-11-27(23-31)37-38(28-12-6-16-32(24-28)48-2)45-42(44-37,36-20-10-22-52-36)46-40(30-14-8-18-34(26-30)50-4)39(29-13-7-17-33(25-29)49-3)43-41(46)35-19-9-21-51-35/h5-26H,1-4H3.
What are the key properties of 2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole?
2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole has a molecular weight of 690.76 g/mol, XLogP of 8.76, 11 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-1-[2-(furan-2-yl)-4,5-bis(3-methoxyphenyl)imidazol-2-yl]-4,5-bis(3-methoxyphenyl)imidazole is sourced from PubChem (CID 102380800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).