8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine

C73H43N7O2 — CID 58099743

IUPAC8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
SMILESc1ccc(-c2ccccc2-c2ccc3c(c2)c2cnccc2n3-c2cccc3c2oc2c(-c4cccc(-c5cc(-n6c7cccnc7c7c(-c8ccccc8-c8ccccn8)cccc76)cc6c5oc5cccnc56)c4)cccc23)nc1
InChIInChI=1S/C73H43N7O2/c1-3-19-51(60-25-5-7-34-75-60)48(17-1)46-31-32-62-57(40-46)59-43-74-38-33-63(59)80(62)66-28-12-24-55-54-23-10-21-49(71(54)82-73(55)66)44-15-9-16-45(39-44)56-41-47(42-58-69-67(81-72(56)58)30-14-37-77-69)79-64-27-11-22-53(68(64)70-65(79)29-13-36-78-70)50-18-2-4-20-52(50)61-26-6-8-35-76-61/h1-43H
InChIKeyUYFRJXNITHHZIW-UHFFFAOYSA-N
MW1050.19 g/mol
LogP18.66
Rot. Bonds8

About 8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine

8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine (PubChem CID 58099743) has the molecular formula C73H43N7O2 and a molecular weight of 1050.19 g/mol. Its IUPAC name is 8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine.

Molecular Properties

Compound Name8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
PubChem CID58099743
Molecular FormulaC73H43N7O2
Molecular Weight1050.19 g/mol
Exact Mass1049.35
IUPAC Name8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine
SMILESc1ccc(-c2ccccc2-c2ccc3c(c2)c2cnccc2n3-c2cccc3c2oc2c(-c4cccc(-c5cc(-n6c7cccnc7c7c(-c8ccccc8-c8ccccn8)cccc76)cc6c5oc5cccnc56)c4)cccc23)nc1
InChIInChI=1S/C73H43N7O2/c1-3-19-51(60-25-5-7-34-75-60)48(17-1)46-31-32-62-57(40-46)59-43-74-38-33-63(59)80(62)66-28-12-24-55-54-23-10-21-49(71(54)82-73(55)66)44-15-9-16-45(39-44)56-41-47(42-58-69-67(81-72(56)58)30-14-37-77-69)79-64-27-11-22-53(68(64)70-65(79)29-13-36-78-70)50-18-2-4-20-52(50)61-26-6-8-35-76-61/h1-43H
InChIKeyUYFRJXNITHHZIW-UHFFFAOYSA-N
XLogP18.66
TPSA100.59 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds8
Heavy Atoms82
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001050.19
LogP ≤ 518.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine?
The IUPAC name of 8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine (CID 58099743) is 8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine.
What is the SMILES notation for 8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine?
The canonical SMILES for 8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine is c1ccc(-c2ccccc2-c2ccc3c(c2)c2cnccc2n3-c2cccc3c2oc2c(-c4cccc(-c5cc(-n6c7cccnc7c7c(-c8ccccc8-c8ccccn8)cccc76)cc6c5oc5cccnc56)c4)cccc23)nc1.
What is the InChIKey of 8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine?
The InChIKey is UYFRJXNITHHZIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H43N7O2/c1-3-19-51(60-25-5-7-34-75-60)48(17-1)46-31-32-62-57(40-46)59-43-74-38-33-63(59)80(62)66-28-12-24-55-54-23-10-21-49(71(54)82-73(55)66)44-15-9-16-45(39-44)56-41-47(42-58-69-67(81-72(56)58)30-14-37-77-69)79-64-27-11-22-53(68(64)70-65(79)29-13-36-78-70)50-18-2-4-20-52(50)61-26-6-8-35-76-61/h1-43H.
What are the key properties of 8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine?
8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine has a molecular weight of 1050.19 g/mol, XLogP of 18.66, 8 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[9-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]-6-[3-[6-[8-(2-pyridin-2-ylphenyl)pyrido[4,3-b]indol-5-yl]dibenzofuran-4-yl]phenyl]-[1]benzofuro[3,2-b]pyridine is sourced from PubChem (CID 58099743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).