2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole

C110H68N10 — CID 138593225

About 2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole

2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole (PubChem CID 138593225) has the molecular formula C110H68N10 and a molecular weight of 1529.82 g/mol. Its IUPAC name is 2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole.

Molecular Properties

• Compound Name: 2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole
• PubChem CID: 138593225
• Molecular Formula: C110H68N10
• Molecular Weight: 1529.82 g/mol
• Exact Mass: 1528.56
• IUPAC Name: 2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole
• SMILES: c1ccc2c(c1)c1ccccc1n2-c1cc(-c2cc(-c3cc(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5c(-c6ccc7c8ccccc8n(-c8cc(-c9cn%10ccccc%10n9)cc(-n9c%10ccccc%10c%10ccccc%109)c8)c7c6)cccc54)c3)cc(-c3cn4ccccc4n3)c2)cc(-n2c3ccccc3c3ccccc32)c1
• InChI: InChI=1S/C110H68N10/c1-11-37-96-83(26-1)84-27-2-12-38-97(84)115(96)76-57-72(58-77(64-76)116-98-39-13-3-28-85(98)86-29-4-14-40-99(86)116)70-54-71(56-74(55-70)94-67-113-52-23-21-48-108(113)111-94)73-59-78(117-100-41-15-5-30-87(100)88-31-6-16-42-101(88)117)65-79(60-73)119-105-46-20-10-35-93(105)110-82(36-25-47-106(110)119)69-50-51-92-91-34-9-19-45-104(91)120(107(92)63-69)81-62-75(95-68-114-53-24-22-49-109(114)112-95)61-80(66-81)118-102-43-17-7-32-89(102)90-33-8-18-44-103(90)118/h1-68H
• InChIKey: MBTZWANLFHIMQD-UHFFFAOYSA-N
• XLogP: 27.90
• TPSA: 64.18 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 11
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1529.82
LogP ≤ 5	27.90
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of 2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole?

The IUPAC name of 2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole (CID 138593225) is 2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole.

What is the SMILES notation for 2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole?

The canonical SMILES for 2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole is c1ccc2c(c1)c1ccccc1n2-c1cc(-c2cc(-c3cc(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5c(-c6ccc7c8ccccc8n(-c8cc(-c9cn%10ccccc%10n9)cc(-n9c%10ccccc%10c%10ccccc%109)c8)c7c6)cccc54)c3)cc(-c3cn4ccccc4n3)c2)cc(-n2c3ccccc3c3ccccc32)c1.

What is the InChIKey of 2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole?

The InChIKey is MBTZWANLFHIMQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C110H68N10/c1-11-37-96-83(26-1)84-27-2-12-38-97(84)115(96)76-57-72(58-77(64-76)116-98-39-13-3-28-85(98)86-29-4-14-40-99(86)116)70-54-71(56-74(55-70)94-67-113-52-23-21-48-108(113)111-94)73-59-78(117-100-41-15-5-30-87(100)88-31-6-16-42-101(88)117)65-79(60-73)119-105-46-20-10-35-93(105)110-82(36-25-47-106(110)119)69-50-51-92-91-34-9-19-45-104(91)120(107(92)63-69)81-62-75(95-68-114-53-24-22-49-109(114)112-95)61-80(66-81)118-102-43-17-7-32-89(102)90-33-8-18-44-103(90)118/h1-68H.

What are the key properties of 2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole?

2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole has a molecular weight of 1529.82 g/mol, XLogP of 27.90, 11 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[9-[3-carbazol-9-yl-5-[3-[3,5-di(carbazol-9-yl)phenyl]-5-imidazo[1,2-a]pyridin-2-ylphenyl]phenyl]carbazol-4-yl]-9-(3-carbazol-9-yl-5-imidazo[1,2-a]pyridin-2-ylphenyl)carbazole is sourced from PubChem (CID 138593225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).