2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole

C32H21NO — CID 166498767

IUPAC2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole
SMILESc1ccc(-c2ccc(C3C(c4cccc5c4oc4ccccc45)=Nc4ccccc43)cc2)cc1
InChIInChI=1S/C32H21NO/c1-2-9-21(10-3-1)22-17-19-23(20-18-22)30-26-12-4-6-15-28(26)33-31(30)27-14-8-13-25-24-11-5-7-16-29(24)34-32(25)27/h1-20,30H
InChIKeyKYBRORUQLFLSEC-UHFFFAOYSA-N
MW435.53 g/mol
LogP8.52
Rot. Bonds3

About 2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole

2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole (PubChem CID 166498767) has the molecular formula C32H21NO and a molecular weight of 435.53 g/mol. Its IUPAC name is 2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole.

Molecular Properties

Compound Name2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole
PubChem CID166498767
Molecular FormulaC32H21NO
Molecular Weight435.53 g/mol
Exact Mass435.16
IUPAC Name2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole
SMILESc1ccc(-c2ccc(C3C(c4cccc5c4oc4ccccc45)=Nc4ccccc43)cc2)cc1
InChIInChI=1S/C32H21NO/c1-2-9-21(10-3-1)22-17-19-23(20-18-22)30-26-12-4-6-15-28(26)33-31(30)27-14-8-13-25-24-11-5-7-16-29(24)34-32(25)27/h1-20,30H
InChIKeyKYBRORUQLFLSEC-UHFFFAOYSA-N
XLogP8.52
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.53
LogP ≤ 58.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-dibenzofuran-4-ylphenyl)-4-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenyl-1,3,5-triazine
CID 165151324
2-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-5-phenyl-1,3,4-oxadiazole
CID 70332148
4-(3-dibenzofuran-4-yl-5-phenylphenyl)dibenzofuran
CID 122451689
4-(4-dibenzofuran-4-ylphenyl)aniline
CID 58510844
4,6-di(dibenzofuran-4-yl)-2-[2-phenyl-6-(4-phenylphenyl)phenyl]pyrimidine
CID 167349519
2-(2-dibenzofuran-4-ylphenyl)-4-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenyl-1,3,5-triazine
CID 165150649
4-[4-[6-(4-phenylphenyl)naphthalen-2-yl]phenyl]dibenzofuran
CID 170289932
2-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-4-phenyl-6-(2-phenylphenyl)-1,3,5-triazine
CID 164942555
2-(4-dibenzofuran-4-ylphenyl)-4-(4-phenylphenyl)-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 168850178
2-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-4,6-bis(2-phenylphenyl)-1,3,5-triazine
CID 164942421
2-dibenzofuran-4-yl-4-(4-phenylphenyl)-1,3,5-triazine
CID 134180001
2-dibenzofuran-4-yl-4-phenyl-6-[4-(11-pyrimidin-2-yl-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl)phenyl]-1,3,5-triazine
CID 165151184

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole?
The IUPAC name of 2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole (CID 166498767) is 2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole.
What is the SMILES notation for 2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole?
The canonical SMILES for 2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole is c1ccc(-c2ccc(C3C(c4cccc5c4oc4ccccc45)=Nc4ccccc43)cc2)cc1.
What is the InChIKey of 2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole?
The InChIKey is KYBRORUQLFLSEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H21NO/c1-2-9-21(10-3-1)22-17-19-23(20-18-22)30-26-12-4-6-15-28(26)33-31(30)27-14-8-13-25-24-11-5-7-16-29(24)34-32(25)27/h1-20,30H.
What are the key properties of 2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole?
2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole has a molecular weight of 435.53 g/mol, XLogP of 8.52, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-4-yl-3-(4-phenylphenyl)-3H-indole is sourced from PubChem (CID 166498767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).