5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole

C128H84N6 — CID 167695725

IUPAC5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6ccccc6)cc5)c34)cc2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2)cc1.c1ccc2cc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc6ccccc6c5)c34)ccc2c1
InChIInChI=1S/C48H32N2.C42H28N2.C38H24N2/c1-4-15-33(16-5-1)36-21-14-22-39(28-36)49-45-25-12-10-23-41(45)43-32-48-44(31-47(43)49)42-24-11-13-26-46(42)50(48)40-29-37(34-17-6-2-7-18-34)27-38(30-40)35-19-8-3-9-20-35;1-3-11-29(12-4-1)31-19-23-33(24-20-31)43-39-18-10-8-16-37(39)41-40(43)28-27-36-35-15-7-9-17-38(35)44(42(36)41)34-25-21-32(22-26-34)30-13-5-2-6-14-30;1-3-11-27-23-29(19-17-25(27)9-1)39-35-16-8-6-14-33(35)37-36(39)22-21-32-31-13-5-7-15-34(31)40(38(32)37)30-20-18-26-10-2-4-12-28(26)24-30/h1-32H;1-28H;1-24H
InChIKeyXPZWYBOFMWUXNL-UHFFFAOYSA-N
MW1706.12 g/mol
LogP34.28
Rot. Bonds11

About 5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole

5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole (PubChem CID 167695725) has the molecular formula C128H84N6 and a molecular weight of 1706.12 g/mol. Its IUPAC name is 5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole.

Molecular Properties

Compound Name5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole
PubChem CID167695725
Molecular FormulaC128H84N6
Molecular Weight1706.12 g/mol
Exact Mass1704.68
IUPAC Name5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6ccccc6)cc5)c34)cc2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2)cc1.c1ccc2cc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc6ccccc6c5)c34)ccc2c1
InChIInChI=1S/C48H32N2.C42H28N2.C38H24N2/c1-4-15-33(16-5-1)36-21-14-22-39(28-36)49-45-25-12-10-23-41(45)43-32-48-44(31-47(43)49)42-24-11-13-26-46(42)50(48)40-29-37(34-17-6-2-7-18-34)27-38(30-40)35-19-8-3-9-20-35;1-3-11-29(12-4-1)31-19-23-33(24-20-31)43-39-18-10-8-16-37(39)41-40(43)28-27-36-35-15-7-9-17-38(35)44(42(36)41)34-25-21-32(22-26-34)30-13-5-2-6-14-30;1-3-11-27-23-29(19-17-25(27)9-1)39-35-16-8-6-14-33(35)37-36(39)22-21-32-31-13-5-7-15-34(31)40(38(32)37)30-20-18-26-10-2-4-12-28(26)24-30/h1-32H;1-28H;1-24H
InChIKeyXPZWYBOFMWUXNL-UHFFFAOYSA-N
XLogP34.28
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms134
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001706.12
LogP ≤ 534.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole?
The IUPAC name of 5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole (CID 167695725) is 5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole.
What is the SMILES notation for 5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole?
The canonical SMILES for 5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole is c1ccc(-c2ccc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6ccccc6)cc5)c34)cc2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc5c(cc43)c3ccccc3n5-c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2)cc1.c1ccc2cc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc6ccccc6c5)c34)ccc2c1.
What is the InChIKey of 5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole?
The InChIKey is XPZWYBOFMWUXNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32N2.C42H28N2.C38H24N2/c1-4-15-33(16-5-1)36-21-14-22-39(28-36)49-45-25-12-10-23-41(45)43-32-48-44(31-47(43)49)42-24-11-13-26-46(42)50(48)40-29-37(34-17-6-2-7-18-34)27-38(30-40)35-19-8-3-9-20-35;1-3-11-29(12-4-1)31-19-23-33(24-20-31)43-39-18-10-8-16-37(39)41-40(43)28-27-36-35-15-7-9-17-38(35)44(42(36)41)34-25-21-32(22-26-34)30-13-5-2-6-14-30;1-3-11-27-23-29(19-17-25(27)9-1)39-35-16-8-6-14-33(35)37-36(39)22-21-32-31-13-5-7-15-34(31)40(38(32)37)30-20-18-26-10-2-4-12-28(26)24-30/h1-32H;1-28H;1-24H.
What are the key properties of 5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole?
5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole has a molecular weight of 1706.12 g/mol, XLogP of 34.28, 11 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,12-bis(4-phenylphenyl)indolo[3,2-c]carbazole;5,12-dinaphthalen-2-ylindolo[3,2-c]carbazole;11-(3,5-diphenylphenyl)-5-(3-phenylphenyl)indolo[3,2-b]carbazole is sourced from PubChem (CID 167695725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).