5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole

C50H32N6 — CID 58570110

IUPAC5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole
SMILESc1ccc(-c2cccc(-c3cccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7cccc(-c8cccc(-c9ccccc9)n8)n7)c6cc54)n3)n2)cc1
InChIInChI=1S/C50H32N6/c1-3-15-33(16-4-1)39-21-11-23-41(51-39)43-25-13-29-49(53-43)55-45-27-9-7-19-35(45)37-31-38-36-20-8-10-28-46(36)56(48(38)32-47(37)55)50-30-14-26-44(54-50)42-24-12-22-40(52-42)34-17-5-2-6-18-34/h1-32H
InChIKeyHUFAJJMIDGVIMX-UHFFFAOYSA-N
MW716.85 g/mol
LogP12.13
Rot. Bonds6

About 5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole

5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole (PubChem CID 58570110) has the molecular formula C50H32N6 and a molecular weight of 716.85 g/mol. Its IUPAC name is 5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole.

Molecular Properties

Compound Name5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole
PubChem CID58570110
Molecular FormulaC50H32N6
Molecular Weight716.85 g/mol
Exact Mass716.27
IUPAC Name5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole
SMILESc1ccc(-c2cccc(-c3cccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7cccc(-c8cccc(-c9ccccc9)n8)n7)c6cc54)n3)n2)cc1
InChIInChI=1S/C50H32N6/c1-3-15-33(16-4-1)39-21-11-23-41(51-39)43-25-13-29-49(53-43)55-45-27-9-7-19-35(45)37-31-38-36-20-8-10-28-46(36)56(48(38)32-47(37)55)50-30-14-26-44(54-50)42-24-12-22-40(52-42)34-17-5-2-6-18-34/h1-32H
InChIKeyHUFAJJMIDGVIMX-UHFFFAOYSA-N
XLogP12.13
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500716.85
LogP ≤ 512.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole
CID 58038356
5-phenyl-11-(6-phenyl-2-pyridinyl)indolo[3,2-b]carbazole
CID 58570053
5,7-bis[6-(3,5-diphenylphenyl)-2-pyridinyl]indolo[2,3-b]carbazole;5,7-bis[6-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole;5,7-bis[6-(4,6-diphenylpyrimidin-2-yl)-2-pyridinyl]indolo[2,3-b]carbazole;5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole
CID 157405731
26-(6-phenyl-2-pyridinyl)-2,26-diazaheptacyclo[15.11.0.02,10.03,8.011,16.019,27.020,25]octacosa-1(28),3,5,7,9,11,13,15,17,19(27),20,22,24-tridecaene
CID 90432826
5-(6-phenyl-2-pyridinyl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[3,2-b]carbazole
CID 118504611
9,14-bis[6-(3-phenylphenyl)-2-pyridinyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9,14-bis(6-phenyl-2-pyridinyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;5-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-7-phenylindolo[2,3-b]carbazole;9-[6-(3-phenylphenyl)-2-pyridinyl]-14-[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 158884122
9-[6-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-phenyl-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]carbazole
CID 138513651
9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole
CID 118041251
9-[6-[6-(6-carbazol-9-yl-2-pyridinyl)-4-(4,6-diphenyl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]carbazole
CID 165167552
7-(4-phenylphenyl)-5-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-b]carbazole
CID 129254521
9-[6-[2-[4-(6-carbazol-9-yl-2-pyridinyl)-6-phenylpyrimidin-2-yl]-6-phenylpyrimidin-4-yl]-2-pyridinyl]carbazole
CID 59500751
11-(6-phenyl-2-pyridinyl)-1,11-diazaheptacyclo[14.12.0.02,14.04,12.05,10.017,22.023,28]octacosa-2,4(12),5,7,9,13,15,17,19,21,23,25,27-tridecaene
CID 118330790

Frequently Asked Questions

What is the IUPAC name of 5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole?
The IUPAC name of 5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole (CID 58570110) is 5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole.
What is the SMILES notation for 5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole?
The canonical SMILES for 5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole is c1ccc(-c2cccc(-c3cccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7cccc(-c8cccc(-c9ccccc9)n8)n7)c6cc54)n3)n2)cc1.
What is the InChIKey of 5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole?
The InChIKey is HUFAJJMIDGVIMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H32N6/c1-3-15-33(16-4-1)39-21-11-23-41(51-39)43-25-13-29-49(53-43)55-45-27-9-7-19-35(45)37-31-38-36-20-8-10-28-46(36)56(48(38)32-47(37)55)50-30-14-26-44(54-50)42-24-12-22-40(52-42)34-17-5-2-6-18-34/h1-32H.
What are the key properties of 5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole?
5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole has a molecular weight of 716.85 g/mol, XLogP of 12.13, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-bis[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]indolo[2,3-b]carbazole is sourced from PubChem (CID 58570110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).