5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole

C108H66N8 — CID 58038303

IUPAC5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole
SMILESc1ccc(-n2c3ccccc3c3ccc4c(c5ccccc5n4-c4cc(-c5cc(-n6c7ccccc7c7c6ccc6c8ccccc8n(-c8ccccc8)c67)cc(-n6c7ccccc7c7c6ccc6c8ccccc8n(-c8ccccc8)c67)c5)cc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7ccccc7)c56)c4)c32)cc1
InChIInChI=1S/C108H66N8/c1-5-29-69(30-6-1)113-89-45-21-13-37-77(89)81-53-57-97-101(105(81)113)85-41-17-25-49-93(85)109(97)73-61-67(62-74(65-73)110-94-50-26-18-42-86(94)102-98(110)58-54-82-78-38-14-22-46-90(78)114(106(82)102)70-31-7-2-8-32-70)68-63-75(111-95-51-27-19-43-87(95)103-99(111)59-55-83-79-39-15-23-47-91(79)115(107(83)103)71-33-9-3-10-34-71)66-76(64-68)112-96-52-28-20-44-88(96)104-100(112)60-56-84-80-40-16-24-48-92(80)116(108(84)104)72-35-11-4-12-36-72/h1-66H
InChIKeyRBLFJSHFOQKLBR-UHFFFAOYSA-N
MW1475.77 g/mol
LogP28.13
Rot. Bonds9

About 5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole

5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole (PubChem CID 58038303) has the molecular formula C108H66N8 and a molecular weight of 1475.77 g/mol. Its IUPAC name is 5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole.

Molecular Properties

Compound Name5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole
PubChem CID58038303
Molecular FormulaC108H66N8
Molecular Weight1475.77 g/mol
Exact Mass1474.54
IUPAC Name5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole
SMILESc1ccc(-n2c3ccccc3c3ccc4c(c5ccccc5n4-c4cc(-c5cc(-n6c7ccccc7c7c6ccc6c8ccccc8n(-c8ccccc8)c67)cc(-n6c7ccccc7c7c6ccc6c8ccccc8n(-c8ccccc8)c67)c5)cc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7ccccc7)c56)c4)c32)cc1
InChIInChI=1S/C108H66N8/c1-5-29-69(30-6-1)113-89-45-21-13-37-77(89)81-53-57-97-101(105(81)113)85-41-17-25-49-93(85)109(97)73-61-67(62-74(65-73)110-94-50-26-18-42-86(94)102-98(110)58-54-82-78-38-14-22-46-90(78)114(106(82)102)70-31-7-2-8-32-70)68-63-75(111-95-51-27-19-43-87(95)103-99(111)59-55-83-79-39-15-23-47-91(79)115(107(83)103)71-33-9-3-10-34-71)66-76(64-68)112-96-52-28-20-44-88(96)104-100(112)60-56-84-80-40-16-24-48-92(80)116(108(84)104)72-35-11-4-12-36-72/h1-66H
InChIKeyRBLFJSHFOQKLBR-UHFFFAOYSA-N
XLogP28.13
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms116
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001475.77
LogP ≤ 528.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole?
The IUPAC name of 5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole (CID 58038303) is 5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole.
What is the SMILES notation for 5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole?
The canonical SMILES for 5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole is c1ccc(-n2c3ccccc3c3ccc4c(c5ccccc5n4-c4cc(-c5cc(-n6c7ccccc7c7c6ccc6c8ccccc8n(-c8ccccc8)c67)cc(-n6c7ccccc7c7c6ccc6c8ccccc8n(-c8ccccc8)c67)c5)cc(-n5c6ccccc6c6c5ccc5c7ccccc7n(-c7ccccc7)c56)c4)c32)cc1.
What is the InChIKey of 5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole?
The InChIKey is RBLFJSHFOQKLBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C108H66N8/c1-5-29-69(30-6-1)113-89-45-21-13-37-77(89)81-53-57-97-101(105(81)113)85-41-17-25-49-93(85)109(97)73-61-67(62-74(65-73)110-94-50-26-18-42-86(94)102-98(110)58-54-82-78-38-14-22-46-90(78)114(106(82)102)70-31-7-2-8-32-70)68-63-75(111-95-51-27-19-43-87(95)103-99(111)59-55-83-79-39-15-23-47-91(79)115(107(83)103)71-33-9-3-10-34-71)66-76(64-68)112-96-52-28-20-44-88(96)104-100(112)60-56-84-80-40-16-24-48-92(80)116(108(84)104)72-35-11-4-12-36-72/h1-66H.
What are the key properties of 5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole?
5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole has a molecular weight of 1475.77 g/mol, XLogP of 28.13, 9 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-5-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]-12-phenylindolo[3,2-c]carbazole is sourced from PubChem (CID 58038303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).