5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole

C152H98N14 — CID 159953025

IUPAC5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole
SMILES[C-]#[N+]c1ccc(-c2cccc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)n2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6cccc(-c7ccccc7)n6)c5cc43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6cccc(-c7ccccc7)n6)c5cc43)n2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccccc6)c5cc43)n2)cc1
InChIInChI=1S/C41H27N3.C40H26N4.C36H22N4.C35H23N3/c1-3-13-28(14-4-1)30-17-11-18-31(25-30)43-37-22-9-7-19-32(37)34-26-35-33-20-8-10-23-38(33)44(40(35)27-39(34)43)41-24-12-21-36(42-41)29-15-5-2-6-16-29;1-3-13-27(14-4-1)33-19-11-23-39(41-33)43-35-21-9-7-17-29(35)31-25-32-30-18-8-10-22-36(30)44(38(32)26-37(31)43)40-24-12-20-34(42-40)28-15-5-2-6-16-28;1-37-25-20-18-24(19-21-25)30-14-9-17-34(38-30)40-31-15-7-5-12-27(31)28-22-23-33-35(36(28)40)29-13-6-8-16-32(29)39(33)26-10-3-2-4-11-26;1-3-12-24(13-4-1)30-18-11-21-35(36-30)38-32-20-10-8-17-27(32)29-22-28-26-16-7-9-19-31(26)37(33(28)23-34(29)38)25-14-5-2-6-15-25/h1-27H;1-26H;2-23H;1-23H
InChIKeyOCIWLTQJHYQCJS-UHFFFAOYSA-N
MW2120.55 g/mol
LogP39.05
Rot. Bonds14

About 5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole

5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole (PubChem CID 159953025) has the molecular formula C152H98N14 and a molecular weight of 2120.55 g/mol. Its IUPAC name is 5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole.

Molecular Properties

Compound Name5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole
PubChem CID159953025
Molecular FormulaC152H98N14
Molecular Weight2120.55 g/mol
Exact Mass2118.81
IUPAC Name5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole
SMILES[C-]#[N+]c1ccc(-c2cccc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)n2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6cccc(-c7ccccc7)n6)c5cc43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6cccc(-c7ccccc7)n6)c5cc43)n2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccccc6)c5cc43)n2)cc1
InChIInChI=1S/C41H27N3.C40H26N4.C36H22N4.C35H23N3/c1-3-13-28(14-4-1)30-17-11-18-31(25-30)43-37-22-9-7-19-32(37)34-26-35-33-20-8-10-23-38(33)44(40(35)27-39(34)43)41-24-12-21-36(42-41)29-15-5-2-6-16-29;1-3-13-27(14-4-1)33-19-11-23-39(41-33)43-35-21-9-7-17-29(35)31-25-32-30-18-8-10-22-36(30)44(38(32)26-37(31)43)40-24-12-20-34(42-40)28-15-5-2-6-16-28;1-37-25-20-18-24(19-21-25)30-14-9-17-34(38-30)40-31-15-7-5-12-27(31)28-22-23-33-35(36(28)40)29-13-6-8-16-32(29)39(33)26-10-3-2-4-11-26;1-3-12-24(13-4-1)30-18-11-21-35(36-30)38-32-20-10-8-17-27(32)29-22-28-26-16-7-9-19-31(26)37(33(28)23-34(29)38)25-14-5-2-6-15-25/h1-27H;1-26H;2-23H;1-23H
InChIKeyOCIWLTQJHYQCJS-UHFFFAOYSA-N
XLogP39.05
TPSA108.25 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds14
Heavy Atoms166
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002120.55
LogP ≤ 539.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole?
The IUPAC name of 5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole (CID 159953025) is 5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole.
What is the SMILES notation for 5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole?
The canonical SMILES for 5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole is [C-]#[N+]c1ccc(-c2cccc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)n2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6cccc(-c7ccccc7)n6)c5cc43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6cccc(-c7ccccc7)n6)c5cc43)n2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccccc6)c5cc43)n2)cc1.
What is the InChIKey of 5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole?
The InChIKey is OCIWLTQJHYQCJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H27N3.C40H26N4.C36H22N4.C35H23N3/c1-3-13-28(14-4-1)30-17-11-18-31(25-30)43-37-22-9-7-19-32(37)34-26-35-33-20-8-10-23-38(33)44(40(35)27-39(34)43)41-24-12-21-36(42-41)29-15-5-2-6-16-29;1-3-13-27(14-4-1)33-19-11-23-39(41-33)43-35-21-9-7-17-29(35)31-25-32-30-18-8-10-22-36(30)44(38(32)26-37(31)43)40-24-12-20-34(42-40)28-15-5-2-6-16-28;1-37-25-20-18-24(19-21-25)30-14-9-17-34(38-30)40-31-15-7-5-12-27(31)28-22-23-33-35(36(28)40)29-13-6-8-16-32(29)39(33)26-10-3-2-4-11-26;1-3-12-24(13-4-1)30-18-11-21-35(36-30)38-32-20-10-8-17-27(32)29-22-28-26-16-7-9-19-31(26)37(33(28)23-34(29)38)25-14-5-2-6-15-25/h1-27H;1-26H;2-23H;1-23H.
What are the key properties of 5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole?
5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole has a molecular weight of 2120.55 g/mol, XLogP of 39.05, 14 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;12-[6-(4-isocyanophenyl)-2-pyridinyl]-5-phenylindolo[3,2-c]carbazole;7-(3-phenylphenyl)-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole is sourced from PubChem (CID 159953025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).