3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole

C98H57N5O3 — CID 126632410

IUPAC3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole
SMILESc1ccc2c(c1)oc1ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccc(-c5ccc(-c6nc(-n7c8ccccc8c8cc(-c9ccc%10oc%11ccccc%11c%10c9)ccc87)nc7ccc(-n8c9ccccc9c9cc(-c%10ccc%11oc%12ccccc%12c%11c%10)ccc98)cc67)cc5)cc4)cc3)cc12
InChIInChI=1S/C98H57N5O3/c1-7-19-85-71(13-1)77-51-63(66-38-48-94-80(54-66)74-16-4-10-22-91(74)104-94)35-45-88(77)101(85)69-41-33-61(34-42-69)59-27-25-58(26-28-59)60-29-31-62(32-30-60)97-83-57-70(102-86-20-8-2-14-72(86)78-52-64(36-46-89(78)102)67-39-49-95-81(55-67)75-17-5-11-23-92(75)105-95)43-44-84(83)99-98(100-97)103-87-21-9-3-15-73(87)79-53-65(37-47-90(79)103)68-40-50-96-82(56-68)76-18-6-12-24-93(76)106-96/h1-57H
InChIKeyJXHVARCWKBBHDM-UHFFFAOYSA-N
MW1352.57 g/mol
LogP26.62
Rot. Bonds9

About 3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole

3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole (PubChem CID 126632410) has the molecular formula C98H57N5O3 and a molecular weight of 1352.57 g/mol. Its IUPAC name is 3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole.

Molecular Properties

Compound Name3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole
PubChem CID126632410
Molecular FormulaC98H57N5O3
Molecular Weight1352.57 g/mol
Exact Mass1351.45
IUPAC Name3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole
SMILESc1ccc2c(c1)oc1ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccc(-c5ccc(-c6nc(-n7c8ccccc8c8cc(-c9ccc%10oc%11ccccc%11c%10c9)ccc87)nc7ccc(-n8c9ccccc9c9cc(-c%10ccc%11oc%12ccccc%12c%11c%10)ccc98)cc67)cc5)cc4)cc3)cc12
InChIInChI=1S/C98H57N5O3/c1-7-19-85-71(13-1)77-51-63(66-38-48-94-80(54-66)74-16-4-10-22-91(74)104-94)35-45-88(77)101(85)69-41-33-61(34-42-69)59-27-25-58(26-28-59)60-29-31-62(32-30-60)97-83-57-70(102-86-20-8-2-14-72(86)78-52-64(36-46-89(78)102)67-39-49-95-81(55-67)75-17-5-11-23-92(75)105-95)43-44-84(83)99-98(100-97)103-87-21-9-3-15-73(87)79-53-65(37-47-90(79)103)68-40-50-96-82(56-68)76-18-6-12-24-93(76)106-96/h1-57H
InChIKeyJXHVARCWKBBHDM-UHFFFAOYSA-N
XLogP26.62
TPSA79.99 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms106
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001352.57
LogP ≤ 526.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole with MolForge

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Related Compounds

3-dibenzofuran-2-yl-9-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]-6-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]quinazolin-2-yl]phenyl]carbazole
CID 126632019
3-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 130355720
9-[4-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-6-(3-dibenzofuran-2-ylcarbazol-9-yl)-1,3,5-triazin-2-yl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 126632674
3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;9-phenyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 158173584
3,6-bis(9-dibenzofuran-2-ylcarbazol-3-yl)-9-phenylcarbazole
CID 88594554
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole
CID 90211475
9-[4-[2,4-bis[4-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-6-yl]phenyl]-3-dibenzofuran-3-ylcarbazole
CID 126631950
9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[4-[4-[2-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]quinazolin-4-yl]phenyl]phenyl]carbazol-3-yl]carbazole
CID 146176762
7-[2-([1]benzofuro[2,3-b]carbazol-7-yl)-6-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]quinazolin-4-yl]-[1]benzofuro[2,3-b]carbazole
CID 126632703
2-dibenzofuran-2-yl-9-[4-[4-(4-phenylphenyl)phenyl]quinazolin-2-yl]carbazole
CID 90129211
3-dibenzofuran-3-yl-9-[3-[6-[3-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]-4-[4-[4-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]phenyl]quinazolin-2-yl]phenyl]carbazole
CID 126631957
3-[8-(9-phenylcarbazol-3-yl)dibenzofuran-1-yl]-9-[4-(4-phenylphenyl)quinazolin-2-yl]carbazole
CID 138475060

Frequently Asked Questions

What is the IUPAC name of 3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole?
The IUPAC name of 3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole (CID 126632410) is 3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole.
What is the SMILES notation for 3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole?
The canonical SMILES for 3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole is c1ccc2c(c1)oc1ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccc(-c5ccc(-c6nc(-n7c8ccccc8c8cc(-c9ccc%10oc%11ccccc%11c%10c9)ccc87)nc7ccc(-n8c9ccccc9c9cc(-c%10ccc%11oc%12ccccc%12c%11c%10)ccc98)cc67)cc5)cc4)cc3)cc12.
What is the InChIKey of 3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole?
The InChIKey is JXHVARCWKBBHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C98H57N5O3/c1-7-19-85-71(13-1)77-51-63(66-38-48-94-80(54-66)74-16-4-10-22-91(74)104-94)35-45-88(77)101(85)69-41-33-61(34-42-69)59-27-25-58(26-28-59)60-29-31-62(32-30-60)97-83-57-70(102-86-20-8-2-14-72(86)78-52-64(36-46-89(78)102)67-39-49-95-81(55-67)75-17-5-11-23-92(75)105-95)43-44-84(83)99-98(100-97)103-87-21-9-3-15-73(87)79-53-65(37-47-90(79)103)68-40-50-96-82(56-68)76-18-6-12-24-93(76)106-96/h1-57H.
What are the key properties of 3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole?
3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole has a molecular weight of 1352.57 g/mol, XLogP of 26.62, 9 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dibenzofuran-2-yl-9-[6-(3-dibenzofuran-2-ylcarbazol-9-yl)-4-[4-[4-[4-(3-dibenzofuran-2-ylcarbazol-9-yl)phenyl]phenyl]phenyl]quinazolin-2-yl]carbazole is sourced from PubChem (CID 126632410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).