2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine

C141H84N12O3 — CID 157054451

IUPAC2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine
SMILESc1ccc2c(c1)oc1cc(-n3c4ccccc4c4cc(-n5c6ccccc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)ccc43)cnc12.c1ccc2c(c1)oc1cc(-n3c4ccccc4c4cc(-n5c6ccccc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)ccc43)ncc12.c1ccc2c(c1)oc1nc(-n3c4ccccc4c4cc(-n5c6ccccc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)ccc43)ccc12
InChIInChI=1S/3C47H28N4O/c1-6-16-39-31(11-1)32-12-2-7-17-40(32)49(39)29-21-24-43-37(27-29)33-13-3-8-18-41(33)50(43)30-22-25-44-38(28-30)34-14-4-9-19-42(34)51(44)46-26-23-36-35-15-5-10-20-45(35)52-47(36)48-46;1-6-16-39-32(11-1)33-12-2-7-17-40(33)49(39)29-21-23-43-37(25-29)34-13-3-8-18-41(34)50(43)30-22-24-44-38(26-30)35-14-4-9-19-42(35)51(44)31-27-46-47(48-28-31)36-15-5-10-20-45(36)52-46;1-6-16-39-31(11-1)32-12-2-7-17-40(32)49(39)29-21-23-43-36(25-29)33-13-3-8-18-41(33)50(43)30-22-24-44-37(26-30)34-14-4-9-19-42(34)51(44)47-27-46-38(28-48-47)35-15-5-10-20-45(35)52-46/h3*1-28H
InChIKeyAAOXAXAWAUZOQC-UHFFFAOYSA-N
MW1994.30 g/mol
LogP36.82
Rot. Bonds9

About 2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine

2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine (PubChem CID 157054451) has the molecular formula C141H84N12O3 and a molecular weight of 1994.30 g/mol. Its IUPAC name is 2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine.

Molecular Properties

Compound Name2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine
PubChem CID157054451
Molecular FormulaC141H84N12O3
Molecular Weight1994.30 g/mol
Exact Mass1992.68
IUPAC Name2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine
SMILESc1ccc2c(c1)oc1cc(-n3c4ccccc4c4cc(-n5c6ccccc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)ccc43)cnc12.c1ccc2c(c1)oc1cc(-n3c4ccccc4c4cc(-n5c6ccccc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)ccc43)ncc12.c1ccc2c(c1)oc1nc(-n3c4ccccc4c4cc(-n5c6ccccc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)ccc43)ccc12
InChIInChI=1S/3C47H28N4O/c1-6-16-39-31(11-1)32-12-2-7-17-40(32)49(39)29-21-24-43-37(27-29)33-13-3-8-18-41(33)50(43)30-22-25-44-38(28-30)34-14-4-9-19-42(34)51(44)46-26-23-36-35-15-5-10-20-45(35)52-47(36)48-46;1-6-16-39-32(11-1)33-12-2-7-17-40(33)49(39)29-21-23-43-37(25-29)34-13-3-8-18-41(34)50(43)30-22-24-44-38(26-30)35-14-4-9-19-42(35)51(44)31-27-46-47(48-28-31)36-15-5-10-20-45(36)52-46;1-6-16-39-31(11-1)32-12-2-7-17-40(32)49(39)29-21-23-43-36(25-29)33-13-3-8-18-41(33)50(43)30-22-24-44-37(26-30)34-14-4-9-19-42(34)51(44)47-27-46-38(28-48-47)35-15-5-10-20-45(35)52-46/h3*1-28H
InChIKeyAAOXAXAWAUZOQC-UHFFFAOYSA-N
XLogP36.82
TPSA122.46 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds9
Heavy Atoms156
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001994.30
LogP ≤ 536.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine?
The IUPAC name of 2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine (CID 157054451) is 2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine.
What is the SMILES notation for 2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine?
The canonical SMILES for 2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine is c1ccc2c(c1)oc1cc(-n3c4ccccc4c4cc(-n5c6ccccc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)ccc43)cnc12.c1ccc2c(c1)oc1cc(-n3c4ccccc4c4cc(-n5c6ccccc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)ccc43)ncc12.c1ccc2c(c1)oc1nc(-n3c4ccccc4c4cc(-n5c6ccccc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)ccc43)ccc12.
What is the InChIKey of 2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine?
The InChIKey is AAOXAXAWAUZOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/3C47H28N4O/c1-6-16-39-31(11-1)32-12-2-7-17-40(32)49(39)29-21-24-43-37(27-29)33-13-3-8-18-41(33)50(43)30-22-25-44-38(28-30)34-14-4-9-19-42(34)51(44)46-26-23-36-35-15-5-10-20-45(35)52-47(36)48-46;1-6-16-39-32(11-1)33-12-2-7-17-40(33)49(39)29-21-23-43-37(25-29)34-13-3-8-18-41(34)50(43)30-22-24-44-38(26-30)35-14-4-9-19-42(35)51(44)31-27-46-47(48-28-31)36-15-5-10-20-45(36)52-46;1-6-16-39-31(11-1)32-12-2-7-17-40(32)49(39)29-21-23-43-36(25-29)33-13-3-8-18-41(33)50(43)30-22-24-44-37(26-30)34-14-4-9-19-42(34)51(44)47-27-46-38(28-48-47)35-15-5-10-20-45(35)52-46/h3*1-28H.
What are the key properties of 2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine?
2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine has a molecular weight of 1994.30 g/mol, XLogP of 36.82, 9 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[2,3-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-b]pyridine;3-[3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-[1]benzofuro[3,2-c]pyridine is sourced from PubChem (CID 157054451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).