1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole

C50H30N4 — CID 166133828

IUPAC1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole
SMILESc1ccc(-c2ccccc2-c2ccccc2-c2c(-c3nc(-c4ccccc4)c4ccccc4n3)ccc3c2-c2c4c(ccc2=N3)=c2ccccc2=N4)cc1
InChIInChI=1S/C50H30N4/c1-3-15-31(16-4-1)33-19-7-8-20-34(33)35-21-9-10-23-37(35)45-40(50-53-42-26-14-12-24-39(42)48(54-50)32-17-5-2-6-18-32)28-30-43-46(45)47-44(51-43)29-27-38-36-22-11-13-25-41(36)52-49(38)47/h1-30H
InChIKeyUGDQKBAKANVPMF-UHFFFAOYSA-N
MW686.82 g/mol
LogP11.45
Rot. Bonds5

About 1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole

1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole (PubChem CID 166133828) has the molecular formula C50H30N4 and a molecular weight of 686.82 g/mol. Its IUPAC name is 1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole.

Molecular Properties

Compound Name1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole
PubChem CID166133828
Molecular FormulaC50H30N4
Molecular Weight686.82 g/mol
Exact Mass686.25
IUPAC Name1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole
SMILESc1ccc(-c2ccccc2-c2ccccc2-c2c(-c3nc(-c4ccccc4)c4ccccc4n3)ccc3c2-c2c4c(ccc2=N3)=c2ccccc2=N4)cc1
InChIInChI=1S/C50H30N4/c1-3-15-31(16-4-1)33-19-7-8-20-34(33)35-21-9-10-23-37(35)45-40(50-53-42-26-14-12-24-39(42)48(54-50)32-17-5-2-6-18-32)28-30-43-46(45)47-44(51-43)29-27-38-36-22-11-13-25-41(36)52-49(38)47/h1-30H
InChIKeyUGDQKBAKANVPMF-UHFFFAOYSA-N
XLogP11.45
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500686.82
LogP ≤ 511.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,3-dinaphthalen-1-ylphenyl)-2-phenylindolo[3,2-c]carbazole
CID 166134514
2-phenyl-1-[2-(2-phenyl-9H-carbazol-1-yl)phenyl]indolo[3,2-c]carbazole
CID 166134906
2-phenyl-1-(3-phenyl-1H-indol-2-yl)indolo[3,2-c]carbazole
CID 166133853
1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole
CID 166135047
1-(2-naphthalen-1-yl-9H-carbazol-1-yl)-2-phenylindolo[3,2-c]carbazole
CID 166135019
1-(5-naphthalen-1-yl-6-phenyltriazin-4-yl)indolo[3,2-c]carbazole
CID 175875644
1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole
CID 171060205
1-[5-(9H-fluoren-1-yl)-6-phenyltriazin-4-yl]-2-phenylindolo[3,2-c]carbazole
CID 166134637
4-phenyl-2-[3-[2-[2-[3-(4-phenylquinazolin-2-yl)phenyl]phenyl]phenyl]phenyl]quinazoline
CID 167202663
1-[5,6-diphenyl-1-[3-phenyl-2-(2-phenylphenyl)indolo[3,2-c]carbazol-1-yl]-2H-triazin-4-yl]-3-phenyl-2-(2-phenylphenyl)indolo[3,2-c]carbazole
CID 175869381
4-[4-[2,3-bis[4-(2-phenylquinazolin-4-yl)phenyl]phenyl]phenyl]-2-phenylquinazoline
CID 170025871
2,4-diphenyl-3-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5(16),6,8,10,12,14-octaene
CID 102532372

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole?
The IUPAC name of 1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole (CID 166133828) is 1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole.
What is the SMILES notation for 1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole?
The canonical SMILES for 1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole is c1ccc(-c2ccccc2-c2ccccc2-c2c(-c3nc(-c4ccccc4)c4ccccc4n3)ccc3c2-c2c4c(ccc2=N3)=c2ccccc2=N4)cc1.
What is the InChIKey of 1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole?
The InChIKey is UGDQKBAKANVPMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H30N4/c1-3-15-31(16-4-1)33-19-7-8-20-34(33)35-21-9-10-23-37(35)45-40(50-53-42-26-14-12-24-39(42)48(54-50)32-17-5-2-6-18-32)28-30-43-46(45)47-44(51-43)29-27-38-36-22-11-13-25-41(36)52-49(38)47/h1-30H.
What are the key properties of 1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole?
1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole has a molecular weight of 686.82 g/mol, XLogP of 11.45, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole is sourced from PubChem (CID 166133828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).