1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole

C54H32N4 — CID 166135047

IUPAC1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole
SMILESc1ccc(-c2ccc3c([nH]c4ccccc43)c2-c2ccc3c(c2-c2c(-c4ccccc4)ccc4c2[nH]c2ccccc24)-c2c4c(ccc2=N3)=c2ccccc2=N4)cc1
InChIInChI=1S/C54H32N4/c1-3-13-31(14-4-1)33-23-25-38-35-17-7-10-20-42(35)56-52(38)47(33)41-28-30-45-50(51-46(55-45)29-27-40-37-19-9-12-22-44(37)58-54(40)51)48(41)49-34(32-15-5-2-6-16-32)24-26-39-36-18-8-11-21-43(36)57-53(39)49/h1-30,56-57H
InChIKeyWNOCEEPNYSAXQS-UHFFFAOYSA-N
MW736.88 g/mol
LogP13.11
Rot. Bonds4

About 1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole

1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole (PubChem CID 166135047) has the molecular formula C54H32N4 and a molecular weight of 736.88 g/mol. Its IUPAC name is 1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole.

Molecular Properties

Compound Name1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole
PubChem CID166135047
Molecular FormulaC54H32N4
Molecular Weight736.88 g/mol
Exact Mass736.26
IUPAC Name1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole
SMILESc1ccc(-c2ccc3c([nH]c4ccccc43)c2-c2ccc3c(c2-c2c(-c4ccccc4)ccc4c2[nH]c2ccccc24)-c2c4c(ccc2=N3)=c2ccccc2=N4)cc1
InChIInChI=1S/C54H32N4/c1-3-13-31(14-4-1)33-23-25-38-35-17-7-10-20-42(35)56-52(38)47(33)41-28-30-45-50(51-46(55-45)29-27-40-37-19-9-12-22-44(37)58-54(40)51)48(41)49-34(32-15-5-2-6-16-32)24-26-39-36-18-8-11-21-43(36)57-53(39)49/h1-30,56-57H
InChIKeyWNOCEEPNYSAXQS-UHFFFAOYSA-N
XLogP13.11
TPSA56.30 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500736.88
LogP ≤ 513.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-phenyl-1-[2-(2-phenyl-9H-carbazol-1-yl)phenyl]indolo[3,2-c]carbazole
CID 166134906
2-(2-phenyl-9H-carbazol-1-yl)-1-[2-(2-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 166133949
1-(2-naphthalen-1-yl-9H-carbazol-1-yl)-2-phenylindolo[3,2-c]carbazole
CID 166135019
2-phenyl-1-(3-phenyl-1H-indol-2-yl)indolo[3,2-c]carbazole
CID 166133853
1-(2,3-dinaphthalen-1-ylphenyl)-2-phenylindolo[3,2-c]carbazole
CID 166134514
1-phenyl-2-(2-phenylphenyl)indolo[3,2-c]carbazole
CID 166133451
1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole
CID 166133828
2-phenyl-9H-carbazol-1-ol
CID 118682381
2-phenyl-1-[2-(2-phenylphenyl)phenyl]-9H-carbazole
CID 175810987
1-[5-(9H-fluoren-1-yl)-6-phenyltriazin-4-yl]-2-phenylindolo[3,2-c]carbazole
CID 166134637
1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole
CID 171060205
1-(5-naphthalen-1-yl-6-phenyltriazin-4-yl)indolo[3,2-c]carbazole
CID 175875644

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole?
The IUPAC name of 1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole (CID 166135047) is 1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole.
What is the SMILES notation for 1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole?
The canonical SMILES for 1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole is c1ccc(-c2ccc3c([nH]c4ccccc43)c2-c2ccc3c(c2-c2c(-c4ccccc4)ccc4c2[nH]c2ccccc24)-c2c4c(ccc2=N3)=c2ccccc2=N4)cc1.
What is the InChIKey of 1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole?
The InChIKey is WNOCEEPNYSAXQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H32N4/c1-3-13-31(14-4-1)33-23-25-38-35-17-7-10-20-42(35)56-52(38)47(33)41-28-30-45-50(51-46(55-45)29-27-40-37-19-9-12-22-44(37)58-54(40)51)48(41)49-34(32-15-5-2-6-16-32)24-26-39-36-18-8-11-21-43(36)57-53(39)49/h1-30,56-57H.
What are the key properties of 1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole?
1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole has a molecular weight of 736.88 g/mol, XLogP of 13.11, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(2-phenyl-9H-carbazol-1-yl)indolo[3,2-c]carbazole is sourced from PubChem (CID 166135047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).