8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine

C92H51N7O4 — CID 134350106

IUPAC8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine
SMILESc1cc(-c2ccc3oc4cccnc4c3c2)cc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc(-c5ccc6oc7cccnc7c6c5)cc(-c5ccc6c(c5)c5cc(-c7ccc8oc9cccnc9c8c7)ccc5n6-c5ccc6oc7cccnc7c6c5)c4)ccc32)c1
InChIInChI=1S/C92H51N7O4/c1-3-14-75-65(12-1)67-44-53(20-28-77(67)97(75)62-11-5-10-52(41-62)56-24-32-81-71(48-56)89-85(100-81)16-6-36-93-89)54-21-29-78-68(45-54)66-13-2-4-15-76(66)99(78)64-42-60(40-61(43-64)59-26-34-83-73(50-59)91-87(102-83)18-8-38-95-91)58-23-31-80-70(47-58)69-46-55(57-25-33-82-72(49-57)90-86(101-82)17-7-37-94-90)22-30-79(69)98(80)63-27-35-84-74(51-63)92-88(103-84)19-9-39-96-92/h1-51H
InChIKeyYYAJECVOHCLUQV-UHFFFAOYSA-N
MW1318.46 g/mol
LogP24.49
Rot. Bonds8

About 8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine

8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine (PubChem CID 134350106) has the molecular formula C92H51N7O4 and a molecular weight of 1318.46 g/mol. Its IUPAC name is 8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine.

Molecular Properties

Compound Name8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine
PubChem CID134350106
Molecular FormulaC92H51N7O4
Molecular Weight1318.46 g/mol
Exact Mass1317.40
IUPAC Name8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine
SMILESc1cc(-c2ccc3oc4cccnc4c3c2)cc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc(-c5ccc6oc7cccnc7c6c5)cc(-c5ccc6c(c5)c5cc(-c7ccc8oc9cccnc9c8c7)ccc5n6-c5ccc6oc7cccnc7c6c5)c4)ccc32)c1
InChIInChI=1S/C92H51N7O4/c1-3-14-75-65(12-1)67-44-53(20-28-77(67)97(75)62-11-5-10-52(41-62)56-24-32-81-71(48-56)89-85(100-81)16-6-36-93-89)54-21-29-78-68(45-54)66-13-2-4-15-76(66)99(78)64-42-60(40-61(43-64)59-26-34-83-73(50-59)91-87(102-83)18-8-38-95-91)58-23-31-80-70(47-58)69-46-55(57-25-33-82-72(49-57)90-86(101-82)17-7-37-94-90)22-30-79(69)98(80)63-27-35-84-74(51-63)92-88(103-84)19-9-39-96-92/h1-51H
InChIKeyYYAJECVOHCLUQV-UHFFFAOYSA-N
XLogP24.49
TPSA118.91 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds8
Heavy Atoms103
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001318.46
LogP ≤ 524.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze 8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine?
The IUPAC name of 8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine (CID 134350106) is 8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine.
What is the SMILES notation for 8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine?
The canonical SMILES for 8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine is c1cc(-c2ccc3oc4cccnc4c3c2)cc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cc(-c5ccc6oc7cccnc7c6c5)cc(-c5ccc6c(c5)c5cc(-c7ccc8oc9cccnc9c8c7)ccc5n6-c5ccc6oc7cccnc7c6c5)c4)ccc32)c1.
What is the InChIKey of 8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine?
The InChIKey is YYAJECVOHCLUQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C92H51N7O4/c1-3-14-75-65(12-1)67-44-53(20-28-77(67)97(75)62-11-5-10-52(41-62)56-24-32-81-71(48-56)89-85(100-81)16-6-36-93-89)54-21-29-78-68(45-54)66-13-2-4-15-76(66)99(78)64-42-60(40-61(43-64)59-26-34-83-73(50-59)91-87(102-83)18-8-38-95-91)58-23-31-80-70(47-58)69-46-55(57-25-33-82-72(49-57)90-86(101-82)17-7-37-94-90)22-30-79(69)98(80)63-27-35-84-74(51-63)92-88(103-84)19-9-39-96-92/h1-51H.
What are the key properties of 8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine?
8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine has a molecular weight of 1318.46 g/mol, XLogP of 24.49, 8 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-6-[3-([1]benzofuro[3,2-b]pyridin-8-yl)-5-[3-[9-[3-([1]benzofuro[3,2-b]pyridin-8-yl)phenyl]carbazol-3-yl]carbazol-9-yl]phenyl]carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine is sourced from PubChem (CID 134350106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).