2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole

C37H24N2O — CID 157379685

IUPAC2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole
SMILESc1ccc(-c2cccc(-n3c(-c4ccc5oc6cc(-c7ccccc7)ccc6c5c4)nc4ccccc43)c2)cc1
InChIInChI=1S/C37H24N2O/c1-3-10-25(11-4-1)27-14-9-15-30(22-27)39-34-17-8-7-16-33(34)38-37(39)29-19-21-35-32(23-29)31-20-18-28(24-36(31)40-35)26-12-5-2-6-13-26/h1-24H
InChIKeyZAFNZJJOECZDJQ-UHFFFAOYSA-N
MW512.61 g/mol
LogP9.93
Rot. Bonds4

About 2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole

2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole (PubChem CID 157379685) has the molecular formula C37H24N2O and a molecular weight of 512.61 g/mol. Its IUPAC name is 2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole.

Molecular Properties

Compound Name2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole
PubChem CID157379685
Molecular FormulaC37H24N2O
Molecular Weight512.61 g/mol
Exact Mass512.19
IUPAC Name2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole
SMILESc1ccc(-c2cccc(-n3c(-c4ccc5oc6cc(-c7ccccc7)ccc6c5c4)nc4ccccc43)c2)cc1
InChIInChI=1S/C37H24N2O/c1-3-10-25(11-4-1)27-14-9-15-30(22-27)39-34-17-8-7-16-33(34)38-37(39)29-19-21-35-32(23-29)31-20-18-28(24-36(31)40-35)26-12-5-2-6-13-26/h1-24H
InChIKeyZAFNZJJOECZDJQ-UHFFFAOYSA-N
XLogP9.93
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500512.61
LogP ≤ 59.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-[4-dibenzofuran-3-yl-6-(3-triphenylen-2-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-1-phenylbenzimidazole
CID 171812807
1-dibenzofuran-2-yl-2-[3-(1-dibenzofuran-2-ylbenzimidazol-2-yl)phenyl]benzimidazole
CID 58037471
N-dibenzofuran-3-yl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]dibenzofuran-3-amine;4-phenyl-N,N-bis[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]aniline;4-phenyl-N-[4-[3-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 161463384
1-dibenzofuran-2-yl-2-phenylbenzimidazole
CID 58401031
9-[3-[4-dibenzofuran-3-yl-6-(8-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 159113305
9-(4-dibenzofuran-2-ylphenyl)-3-[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole
CID 118149535
2-[4-[9,10-bis(naphtho[2,3-b][1]benzofuran-2-yl)anthracen-2-yl]phenyl]-1-phenylbenzimidazole
CID 118503477
1-[3-(10-dibenzofuran-2-ylanthracen-9-yl)phenyl]-2-(2,3,4,5,6-pentadeuteriophenyl)benzimidazole
CID 169071529
2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-1-(3-phenylphenyl)benzimidazole
CID 155173937
14-[4-[3-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]-3-oxa-15-azapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16,18,20-decaene
CID 129123411
2-(9-chlorodibenzofuran-2-yl)-1-phenylbenzimidazole
CID 155477397
9-[3-[4-dibenzofuran-3-yl-6-(7-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 149015024

Frequently Asked Questions

What is the IUPAC name of 2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole?
The IUPAC name of 2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole (CID 157379685) is 2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole.
What is the SMILES notation for 2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole?
The canonical SMILES for 2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole is c1ccc(-c2cccc(-n3c(-c4ccc5oc6cc(-c7ccccc7)ccc6c5c4)nc4ccccc43)c2)cc1.
What is the InChIKey of 2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole?
The InChIKey is ZAFNZJJOECZDJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H24N2O/c1-3-10-25(11-4-1)27-14-9-15-30(22-27)39-34-17-8-7-16-33(34)38-37(39)29-19-21-35-32(23-29)31-20-18-28(24-36(31)40-35)26-12-5-2-6-13-26/h1-24H.
What are the key properties of 2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole?
2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole has a molecular weight of 512.61 g/mol, XLogP of 9.93, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-phenyldibenzofuran-2-yl)-1-(3-phenylphenyl)benzimidazole is sourced from PubChem (CID 157379685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).