7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine

C28H23N3O — CID 164827202

IUPAC7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine
SMILESCC(C)(C)c1cncc2c1nc(-c1cccc3c1oc1ccccc13)n2-c1ccccc1
InChIInChI=1S/C28H23N3O/c1-28(2,3)22-16-29-17-23-25(22)30-27(31(23)18-10-5-4-6-11-18)21-14-9-13-20-19-12-7-8-15-24(19)32-26(20)21/h4-17H,1-3H3
InChIKeyVYCGGKBCNKLYMP-UHFFFAOYSA-N
MW417.51 g/mol
LogP7.28
Rot. Bonds2

About 7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine

7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine (PubChem CID 164827202) has the molecular formula C28H23N3O and a molecular weight of 417.51 g/mol. Its IUPAC name is 7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine
PubChem CID164827202
Molecular FormulaC28H23N3O
Molecular Weight417.51 g/mol
Exact Mass417.18
IUPAC Name7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine
SMILESCC(C)(C)c1cncc2c1nc(-c1cccc3c1oc1ccccc13)n2-c1ccccc1
InChIInChI=1S/C28H23N3O/c1-28(2,3)22-16-29-17-23-25(22)30-27(31(23)18-10-5-4-6-11-18)21-14-9-13-20-19-12-7-8-15-24(19)32-26(20)21/h4-17H,1-3H3
InChIKeyVYCGGKBCNKLYMP-UHFFFAOYSA-N
XLogP7.28
TPSA43.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500417.51
LogP ≤ 57.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

7-tert-butyl-2-(1-methyldibenzofuran-4-yl)-3-phenylimidazo[4,5-c]pyridine
CID 164825336
6-tert-butyl-2-dibenzofuran-4-yl-1-phenylimidazo[4,5-b]pyridine
CID 164826557
2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine
CID 156658408
2-(4-dibenzofuran-4-yl-1-phenylbenzimidazol-2-yl)aniline
CID 138712154
7-tert-butyl-2-(3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4(9),5,7,11,14,16,18,20-decaen-5-yl)-1-phenylimidazo[4,5-c]pyridine
CID 164825662
2-tert-butyl-5-dibenzofuran-4-yl-4-(4-phenylphenyl)imidazo[4,5-d][1,3]thiazole
CID 169044075
2-(4-dibenzofuran-4-yl-2,5-dimethylphenyl)-1-phenylbenzimidazole
CID 58309657
[6-(6-tert-butyl-1-phenylimidazo[4,5-b]pyridin-2-yl)dibenzofuran-3-yl]-trimethylsilane
CID 164826115
[6-(6-tert-butyl-1-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylsilane
CID 164825170
[6-(6-tert-butyl-3-phenylimidazo[4,5-c]pyridin-2-yl)dibenzofuran-3-yl]-trimethylsilane
CID 164826811
9-[4-(7-tert-butyl-1-phenylbenzimidazol-2-yl)phenyl]-3-dibenzofuran-4-ylcarbazole
CID 67819109
2-methyl-8-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-c]pyridin-2-ium
CID 176644026

Frequently Asked Questions

What is the IUPAC name of 7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine?
The IUPAC name of 7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine (CID 164827202) is 7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine.
What is the SMILES notation for 7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine?
The canonical SMILES for 7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine is CC(C)(C)c1cncc2c1nc(-c1cccc3c1oc1ccccc13)n2-c1ccccc1.
What is the InChIKey of 7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine?
The InChIKey is VYCGGKBCNKLYMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H23N3O/c1-28(2,3)22-16-29-17-23-25(22)30-27(31(23)18-10-5-4-6-11-18)21-14-9-13-20-19-12-7-8-15-24(19)32-26(20)21/h4-17H,1-3H3.
What are the key properties of 7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine?
7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine has a molecular weight of 417.51 g/mol, XLogP of 7.28, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-tert-butyl-2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine is sourced from PubChem (CID 164827202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).