3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane

C157H103N7Si — CID 157370354

About 3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane

3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane (PubChem CID 157370354) has the molecular formula C157H103N7Si and a molecular weight of 2115.69 g/mol. Its IUPAC name is 3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane.

Molecular Properties

• Compound Name: 3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane
• PubChem CID: 157370354
• Molecular Formula: C157H103N7Si
• Molecular Weight: 2115.69 g/mol
• Exact Mass: 2113.80
• IUPAC Name: 3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane
• SMILES: N#Cc1cccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccccc5)cc4)ccc32)c1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc6c7ccccc7c7ccccc7c6c5)ccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)c5)ccc43)cc2)cc1
• InChI: InChI=1S/C60H42N2Si.C54H34N2.C43H27N3/c1-5-18-43(19-6-1)44-32-36-47(37-33-44)61-57-30-15-13-28-53(57)55-40-45(34-38-59(55)61)46-35-39-60-56(41-46)54-29-14-16-31-58(54)62(60)48-20-17-27-52(42-48)63(49-21-7-2-8-22-49,50-23-9-3-10-24-50)51-25-11-4-12-26-51;1-2-12-35(13-3-1)36-22-26-39(27-23-36)55-51-20-10-8-18-46(51)49-32-37(24-30-53(49)55)38-25-31-54-50(33-38)47-19-9-11-21-52(47)56(54)40-28-29-45-43-16-5-4-14-41(43)42-15-6-7-17-44(42)48(45)34-40;44-28-29-9-8-12-35(25-29)46-41-16-7-5-14-37(41)39-27-33(20-24-43(39)46)32-19-23-42-38(26-32)36-13-4-6-15-40(36)45(42)34-21-17-31(18-22-34)30-10-2-1-3-11-30/h1-42H;1-34H;1-27H
• InChIKey: BJRNJMQQAWQGLG-UHFFFAOYSA-N
• XLogP: 38.35
• TPSA: 53.37 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 16
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2115.69
LogP ≤ 5	38.35
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane?

The IUPAC name of 3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane (CID 157370354) is 3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane.

What is the SMILES notation for 3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane?

The canonical SMILES for 3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane is N#Cc1cccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccccc5)cc4)ccc32)c1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc6c7ccccc7c7ccccc7c6c5)ccc43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)c5)ccc43)cc2)cc1.

What is the InChIKey of 3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane?

The InChIKey is BJRNJMQQAWQGLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H42N2Si.C54H34N2.C43H27N3/c1-5-18-43(19-6-1)44-32-36-47(37-33-44)61-57-30-15-13-28-53(57)55-40-45(34-38-59(55)61)46-35-39-60-56(41-46)54-29-14-16-31-58(54)62(60)48-20-17-27-52(42-48)63(49-21-7-2-8-22-49,50-23-9-3-10-24-50)51-25-11-4-12-26-51;1-2-12-35(13-3-1)36-22-26-39(27-23-36)55-51-20-10-8-18-46(51)49-32-37(24-30-53(49)55)38-25-31-54-50(33-38)47-19-9-11-21-52(47)56(54)40-28-29-45-43-16-5-4-14-41(43)42-15-6-7-17-44(42)48(45)34-40;44-28-29-9-8-12-35(25-29)46-41-16-7-5-14-37(41)39-27-33(20-24-43(39)46)32-19-23-42-38(26-32)36-13-4-6-15-40(36)45(42)34-21-17-31(18-22-34)30-10-2-1-3-11-30/h1-42H;1-34H;1-27H.

What are the key properties of 3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane?

3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane has a molecular weight of 2115.69 g/mol, XLogP of 38.35, 16 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzonitrile;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole;triphenyl-[3-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]silane is sourced from PubChem (CID 157370354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).