1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole

C39H23N5 — CID 171060205

IUPAC1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole
SMILESc1ccc(-c2ccccc2-c2nnnc(-c3cccc4c3-c3c5c(ccc3=N4)=c3ccccc3=N5)c2-c2ccccc2)cc1
InChIInChI=1S/C39H23N5/c1-3-12-24(13-4-1)26-16-7-8-18-28(26)38-34(25-14-5-2-6-15-25)39(43-44-42-38)30-19-11-21-32-35(30)36-33(40-32)23-22-29-27-17-9-10-20-31(27)41-37(29)36/h1-23H
InChIKeyGCSDMENYVZDGCK-UHFFFAOYSA-N
MW561.65 g/mol
LogP8.02
Rot. Bonds4

About 1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole

1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole (PubChem CID 171060205) has the molecular formula C39H23N5 and a molecular weight of 561.65 g/mol. Its IUPAC name is 1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole.

Molecular Properties

Compound Name1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole
PubChem CID171060205
Molecular FormulaC39H23N5
Molecular Weight561.65 g/mol
Exact Mass561.20
IUPAC Name1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole
SMILESc1ccc(-c2ccccc2-c2nnnc(-c3cccc4c3-c3c5c(ccc3=N4)=c3ccccc3=N5)c2-c2ccccc2)cc1
InChIInChI=1S/C39H23N5/c1-3-12-24(13-4-1)26-16-7-8-18-28(26)38-34(25-14-5-2-6-15-25)39(43-44-42-38)30-19-11-21-32-35(30)36-33(40-32)23-22-29-27-17-9-10-20-31(27)41-37(29)36/h1-23H
InChIKeyGCSDMENYVZDGCK-UHFFFAOYSA-N
XLogP8.02
TPSA63.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500561.65
LogP ≤ 58.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(5-naphthalen-1-yl-6-phenyltriazin-4-yl)indolo[3,2-c]carbazole
CID 175875644
1-phenyl-2-(2-phenylphenyl)indolo[3,2-c]carbazole
CID 166133451
1-[5-(9H-fluoren-1-yl)-6-phenyltriazin-4-yl]-2-phenylindolo[3,2-c]carbazole
CID 166134637
3,4-ditert-butyl-2-phenyl-1-[6-phenyl-5-[2-(2-phenylphenyl)phenyl]triazin-4-yl]indolo[3,2-c]carbazole
CID 166134634
2,3-ditert-butyl-1-(5,6-diphenyltriazin-4-yl)-4-phenylindolo[3,2-c]carbazole
CID 166133624
1-[2-(2-phenylphenyl)phenyl]-2-(4-phenylquinazolin-2-yl)indolo[3,2-c]carbazole
CID 166133828
1-(2,3-dinaphthalen-1-ylphenyl)-2-phenylindolo[3,2-c]carbazole
CID 166134514
2-phenyl-1-(3-phenyl-1H-indol-2-yl)indolo[3,2-c]carbazole
CID 166133853
1-cinnolin-3-yl-2-phenylindolo[3,2-c]carbazole
CID 166134412
2-(2-phenyl-9H-carbazol-1-yl)-1-[2-(2-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 166133949
2-phenyl-1-[2-(2-phenyl-9H-carbazol-1-yl)phenyl]indolo[3,2-c]carbazole
CID 166134906
1-(2-naphthalen-1-yl-9H-carbazol-1-yl)-2-phenylindolo[3,2-c]carbazole
CID 166135019

Frequently Asked Questions

What is the IUPAC name of 1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole?
The IUPAC name of 1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole (CID 171060205) is 1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole.
What is the SMILES notation for 1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole?
The canonical SMILES for 1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole is c1ccc(-c2ccccc2-c2nnnc(-c3cccc4c3-c3c5c(ccc3=N4)=c3ccccc3=N5)c2-c2ccccc2)cc1.
What is the InChIKey of 1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole?
The InChIKey is GCSDMENYVZDGCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H23N5/c1-3-12-24(13-4-1)26-16-7-8-18-28(26)38-34(25-14-5-2-6-15-25)39(43-44-42-38)30-19-11-21-32-35(30)36-33(40-32)23-22-29-27-17-9-10-20-31(27)41-37(29)36/h1-23H.
What are the key properties of 1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole?
1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole has a molecular weight of 561.65 g/mol, XLogP of 8.02, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-phenyl-6-(2-phenylphenyl)triazin-4-yl]indolo[3,2-c]carbazole is sourced from PubChem (CID 171060205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).