6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole

C106H70N6 — CID 160506334

About 6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole

6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole (PubChem CID 160506334) has the molecular formula C106H70N6 and a molecular weight of 1427.77 g/mol. Its IUPAC name is 6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole.

Molecular Properties

• Compound Name: 6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole
• PubChem CID: 160506334
• Molecular Formula: C106H70N6
• Molecular Weight: 1427.77 g/mol
• Exact Mass: 1426.57
• IUPAC Name: 6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole
• SMILES: c1ccc(-c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)cc(-n3c4ccccc4c4c5ccn(-c6ccccc6)c5ccc43)c2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2cccc(-n3c4ccccc4c4c5ccn(-c6ccccc6)c5ccc43)c2)cc1
• InChI: InChI=1S/C56H37N3.C50H33N3/c1-5-15-38(16-6-1)41-25-27-53-49(35-41)50-36-42(39-17-7-2-8-18-39)26-28-54(50)58(53)45-33-43(40-19-9-3-10-20-40)34-46(37-45)59-52-24-14-13-23-47(52)56-48-31-32-57(44-21-11-4-12-22-44)51(48)29-30-55(56)59;1-4-13-34(14-5-1)36-23-25-47-43(31-36)44-32-37(35-15-6-2-7-16-35)24-26-48(44)52(47)39-19-12-20-40(33-39)53-46-22-11-10-21-41(46)50-42-29-30-51(38-17-8-3-9-18-38)45(42)27-28-49(50)53/h1-37H;1-33H
• InChIKey: QSLMONIRPGERLS-UHFFFAOYSA-N
• XLogP: 27.98
• TPSA: 29.58 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 11
• Heavy Atoms: 112
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1427.77
LogP ≤ 5	27.98
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole?

The IUPAC name of 6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole (CID 160506334) is 6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole.

What is the SMILES notation for 6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole?

The canonical SMILES for 6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole is c1ccc(-c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)cc(-n3c4ccccc4c4c5ccn(-c6ccccc6)c5ccc43)c2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2cccc(-n3c4ccccc4c4c5ccn(-c6ccccc6)c5ccc43)c2)cc1.

What is the InChIKey of 6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole?

The InChIKey is QSLMONIRPGERLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H37N3.C50H33N3/c1-5-15-38(16-6-1)41-25-27-53-49(35-41)50-36-42(39-17-7-2-8-18-39)26-28-54(50)58(53)45-33-43(40-19-9-3-10-20-40)34-46(37-45)59-52-24-14-13-23-47(52)56-48-31-32-57(44-21-11-4-12-22-44)51(48)29-30-55(56)59;1-4-13-34(14-5-1)36-23-25-47-43(31-36)44-32-37(35-15-6-2-7-16-35)24-26-48(44)52(47)39-19-12-20-40(33-39)53-46-22-11-10-21-41(46)50-42-29-30-51(38-17-8-3-9-18-38)45(42)27-28-49(50)53/h1-37H;1-33H.

What are the key properties of 6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole?

6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole has a molecular weight of 1427.77 g/mol, XLogP of 27.98, 11 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[3-(3,6-diphenylcarbazol-9-yl)-5-phenylphenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole is sourced from PubChem (CID 160506334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).