1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole

C46H32N2 — CID 71230374

IUPAC1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole
SMILESc1ccc(-c2ccc(-n3c(-c4ccccc4)cc4ccc(-c5ccc6cc(-c7ccccc7)n(-c7ccccc7)c6c5)cc43)cc2)cc1
InChIInChI=1S/C46H32N2/c1-5-13-33(14-6-1)34-25-27-42(28-26-34)48-44(36-17-9-3-10-18-36)32-40-24-22-38(30-46(40)48)37-21-23-39-31-43(35-15-7-2-8-16-35)47(45(39)29-37)41-19-11-4-12-20-41/h1-32H
InChIKeyPXSZYUZSQYGPRM-UHFFFAOYSA-N
MW612.78 g/mol
LogP12.24
Rot. Bonds6

About 1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole

1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole (PubChem CID 71230374) has the molecular formula C46H32N2 and a molecular weight of 612.78 g/mol. Its IUPAC name is 1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole.

Molecular Properties

Compound Name1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole
PubChem CID71230374
Molecular FormulaC46H32N2
Molecular Weight612.78 g/mol
Exact Mass612.26
IUPAC Name1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole
SMILESc1ccc(-c2ccc(-n3c(-c4ccccc4)cc4ccc(-c5ccc6cc(-c7ccccc7)n(-c7ccccc7)c6c5)cc43)cc2)cc1
InChIInChI=1S/C46H32N2/c1-5-13-33(14-6-1)34-25-27-42(28-26-34)48-44(36-17-9-3-10-18-36)32-40-24-22-38(30-46(40)48)37-21-23-39-31-43(35-15-7-2-8-16-35)47(45(39)29-37)41-19-11-4-12-20-41/h1-32H
InChIKeyPXSZYUZSQYGPRM-UHFFFAOYSA-N
XLogP12.24
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500612.78
LogP ≤ 512.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,2-dinaphthalen-2-yl-6-(2-naphthalen-2-yl-1-phenylindol-5-yl)indole
CID 144508733
1-(9,9-dimethylfluoren-2-yl)-6-(1,2-diphenylindol-6-yl)-2-phenylindole
CID 71229871
N-phenyl-N-[4-(2-phenylindol-1-yl)phenyl]-4-[4-(N-[4-(2-phenylindol-1-yl)phenyl]anilino)phenyl]aniline
CID 144768904
[4-[1-(4-methylphenyl)-2,6-bis(4-phenylphenyl)pyrrolo[2,3-f]indol-5-yl]phenyl]phosphane
CID 71016750
2-(9-phenylcarbazol-2-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 142356248
1,2-bis(4-methylphenyl)indole
CID 151814608
9-[4-(6-phenylnaphthalen-2-yl)phenyl]carbazole
CID 58971457
3,10-bis(3,6-diphenylcarbazol-9-yl)-15-phenyl-15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaene
CID 118137482
2-phenyl-7-(1-phenylindol-2-yl)-9H-carbazole
CID 167239516
3-(9-phenylcarbazol-3-yl)-9-(6-phenylnaphthalen-2-yl)carbazole
CID 118581886
N,N-diphenyl-4-(1-phenylindol-2-yl)aniline
CID 59993805
3-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
CID 164948724

Frequently Asked Questions

What is the IUPAC name of 1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole?
The IUPAC name of 1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole (CID 71230374) is 1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole.
What is the SMILES notation for 1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole?
The canonical SMILES for 1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole is c1ccc(-c2ccc(-n3c(-c4ccccc4)cc4ccc(-c5ccc6cc(-c7ccccc7)n(-c7ccccc7)c6c5)cc43)cc2)cc1.
What is the InChIKey of 1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole?
The InChIKey is PXSZYUZSQYGPRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H32N2/c1-5-13-33(14-6-1)34-25-27-42(28-26-34)48-44(36-17-9-3-10-18-36)32-40-24-22-38(30-46(40)48)37-21-23-39-31-43(35-15-7-2-8-16-35)47(45(39)29-37)41-19-11-4-12-20-41/h1-32H.
What are the key properties of 1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole?
1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole has a molecular weight of 612.78 g/mol, XLogP of 12.24, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole is sourced from PubChem (CID 71230374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).