9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole

C144H86N6O3 — CID 167270452

IUPAC9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccccc6-c6ccc7oc8cc(-c9cc(-c%10ccc%11c%12ccccc%12n(-c%12ccccc%12)c%11c%10)cc%10c9c9ccccc9n%10-c9ccccc9-c9cccc%10c9oc9cc(-c%11cc(-c%12ccc%13c%14ccccc%14n(-c%14ccccc%14)c%13c%12)cc%12c%11c%11ccccc%11n%12-c%11ccccc%11-c%11cccc%12oc%13ccccc%13c%11%12)ccc9%10)ccc8c7c6)c5c4)cc32)cc1
InChIInChI=1S/C144H86N6O3/c1-4-32-96(33-5-1)145-122-52-21-11-39-100(122)106-69-62-87(79-130(106)145)88-63-70-109-103-42-14-24-55-125(103)148(133(109)80-88)121-51-20-10-38-99(121)91-68-75-137-120(76-91)111-74-67-92(85-139(111)152-137)118-77-94(89-64-71-107-101-40-12-22-53-123(101)146(131(107)81-89)97-34-6-2-7-35-97)84-135-141(118)116-46-18-28-59-129(116)150(135)127-57-26-16-44-105(127)113-49-30-50-114-110-73-66-93(86-140(110)153-144(113)114)119-78-95(90-65-72-108-102-41-13-23-54-124(102)147(132(108)82-90)98-36-8-3-9-37-98)83-134-142(119)115-45-17-27-58-128(115)149(134)126-56-25-15-43-104(126)112-48-31-61-138-143(112)117-47-19-29-60-136(117)151-138/h1-86H
InChIKeyQFDJRVXLHKLVNR-UHFFFAOYSA-N
MW1948.31 g/mol
LogP39.30
Rot. Bonds14

About 9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole

9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole (PubChem CID 167270452) has the molecular formula C144H86N6O3 and a molecular weight of 1948.31 g/mol. Its IUPAC name is 9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole.

Molecular Properties

Compound Name9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole
PubChem CID167270452
Molecular FormulaC144H86N6O3
Molecular Weight1948.31 g/mol
Exact Mass1946.68
IUPAC Name9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccccc6-c6ccc7oc8cc(-c9cc(-c%10ccc%11c%12ccccc%12n(-c%12ccccc%12)c%11c%10)cc%10c9c9ccccc9n%10-c9ccccc9-c9cccc%10c9oc9cc(-c%11cc(-c%12ccc%13c%14ccccc%14n(-c%14ccccc%14)c%13c%12)cc%12c%11c%11ccccc%11n%12-c%11ccccc%11-c%11cccc%12oc%13ccccc%13c%11%12)ccc9%10)ccc8c7c6)c5c4)cc32)cc1
InChIInChI=1S/C144H86N6O3/c1-4-32-96(33-5-1)145-122-52-21-11-39-100(122)106-69-62-87(79-130(106)145)88-63-70-109-103-42-14-24-55-125(103)148(133(109)80-88)121-51-20-10-38-99(121)91-68-75-137-120(76-91)111-74-67-92(85-139(111)152-137)118-77-94(89-64-71-107-101-40-12-22-53-123(101)146(131(107)81-89)97-34-6-2-7-35-97)84-135-141(118)116-46-18-28-59-129(116)150(135)127-57-26-16-44-105(127)113-49-30-50-114-110-73-66-93(86-140(110)153-144(113)114)119-78-95(90-65-72-108-102-41-13-23-54-124(102)147(132(108)82-90)98-36-8-3-9-37-98)83-134-142(119)115-45-17-27-58-128(115)149(134)126-56-25-15-43-104(126)112-48-31-61-138-143(112)117-47-19-29-60-136(117)151-138/h1-86H
InChIKeyQFDJRVXLHKLVNR-UHFFFAOYSA-N
XLogP39.30
TPSA69.00 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds14
Heavy Atoms153
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001948.31
LogP ≤ 539.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole?
The IUPAC name of 9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole (CID 167270452) is 9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole.
What is the SMILES notation for 9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole?
The canonical SMILES for 9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole is c1ccc(-n2c3ccccc3c3ccc(-c4ccc5c6ccccc6n(-c6ccccc6-c6ccc7oc8cc(-c9cc(-c%10ccc%11c%12ccccc%12n(-c%12ccccc%12)c%11c%10)cc%10c9c9ccccc9n%10-c9ccccc9-c9cccc%10c9oc9cc(-c%11cc(-c%12ccc%13c%14ccccc%14n(-c%14ccccc%14)c%13c%12)cc%12c%11c%11ccccc%11n%12-c%11ccccc%11-c%11cccc%12oc%13ccccc%13c%11%12)ccc9%10)ccc8c7c6)c5c4)cc32)cc1.
What is the InChIKey of 9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole?
The InChIKey is QFDJRVXLHKLVNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C144H86N6O3/c1-4-32-96(33-5-1)145-122-52-21-11-39-100(122)106-69-62-87(79-130(106)145)88-63-70-109-103-42-14-24-55-125(103)148(133(109)80-88)121-51-20-10-38-99(121)91-68-75-137-120(76-91)111-74-67-92(85-139(111)152-137)118-77-94(89-64-71-107-101-40-12-22-53-123(101)146(131(107)81-89)97-34-6-2-7-35-97)84-135-141(118)116-46-18-28-59-129(116)150(135)127-57-26-16-44-105(127)113-49-30-50-114-110-73-66-93(86-140(110)153-144(113)114)119-78-95(90-65-72-108-102-41-13-23-54-124(102)147(132(108)82-90)98-36-8-3-9-37-98)83-134-142(119)115-45-17-27-58-128(115)149(134)126-56-25-15-43-104(126)112-48-31-61-138-143(112)117-47-19-29-60-136(117)151-138/h1-86H.
What are the key properties of 9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole?
9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole has a molecular weight of 1948.31 g/mol, XLogP of 39.30, 14 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-dibenzofuran-1-ylphenyl)-2-(9-phenylcarbazol-2-yl)-4-[6-[2-[2-(9-phenylcarbazol-2-yl)-4-[8-[2-[2-(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazol-9-yl]phenyl]dibenzofuran-3-yl]carbazole is sourced from PubChem (CID 167270452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).