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

C102H59N5O3 — CID 126631881

IUPAC2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole
SMILESc1cc(-c2ccc3nc(-c4cccc(-n5c6ccccc6c6ccc(-c7ccc8c(c7)oc7ccccc78)cc65)c4)nc(-c4ccc5cc(-n6c7ccccc7c7ccc(-c8ccc9c(c8)oc8ccccc89)cc76)ccc5c4)c3c2)cc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)oc4ccccc45)cc32)c1
InChIInChI=1S/C102H59N5O3/c1-7-25-89-75(19-1)78-42-34-64(67-37-45-84-81-22-4-10-28-95(81)108-98(84)57-67)54-92(78)105(89)72-17-13-15-60(50-72)63-40-48-88-87(53-63)101(104-102(103-88)71-16-14-18-73(52-71)106-90-26-8-2-20-76(90)79-43-35-65(55-93(79)106)68-38-46-85-82-23-5-11-29-96(82)109-99(85)58-68)70-32-31-62-51-74(41-33-61(62)49-70)107-91-27-9-3-21-77(91)80-44-36-66(56-94(80)107)69-39-47-86-83-24-6-12-30-97(83)110-100(86)59-69/h1-59H
InChIKeyJFUWBEOBLIGEDJ-UHFFFAOYSA-N
MW1402.63 g/mol
LogP27.77
Rot. Bonds9

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

2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole (PubChem CID 126631881) has the molecular formula C102H59N5O3 and a molecular weight of 1402.63 g/mol. Its IUPAC name is 2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole.

Molecular Properties

Compound Name2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole
PubChem CID126631881
Molecular FormulaC102H59N5O3
Molecular Weight1402.63 g/mol
Exact Mass1401.46
IUPAC Name2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole
SMILESc1cc(-c2ccc3nc(-c4cccc(-n5c6ccccc6c6ccc(-c7ccc8c(c7)oc7ccccc78)cc65)c4)nc(-c4ccc5cc(-n6c7ccccc7c7ccc(-c8ccc9c(c8)oc8ccccc89)cc76)ccc5c4)c3c2)cc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)oc4ccccc45)cc32)c1
InChIInChI=1S/C102H59N5O3/c1-7-25-89-75(19-1)78-42-34-64(67-37-45-84-81-22-4-10-28-95(81)108-98(84)57-67)54-92(78)105(89)72-17-13-15-60(50-72)63-40-48-88-87(53-63)101(104-102(103-88)71-16-14-18-73(52-71)106-90-26-8-2-20-76(90)79-43-35-65(55-93(79)106)68-38-46-85-82-23-5-11-29-96(82)109-99(85)58-68)70-32-31-62-51-74(41-33-61(62)49-70)107-91-27-9-3-21-77(91)80-44-36-66(56-94(80)107)69-39-47-86-83-24-6-12-30-97(83)110-100(86)59-69/h1-59H
InChIKeyJFUWBEOBLIGEDJ-UHFFFAOYSA-N
XLogP27.77
TPSA79.99 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms110
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001402.63
LogP ≤ 527.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Related Compounds

2-dibenzofuran-3-yl-9-[6-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[4-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]naphthalen-2-yl]carbazole
CID 126631880
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
11-[3-[4-[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]-6-[4-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-2-yl]phenyl]-[1]benzofuro[3,2-b]carbazole
CID 126630945
2-dibenzofuran-3-yl-9-[4-[4-[4-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]-6-[4-[4-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]phenyl]quinazolin-2-yl]phenyl]carbazole
CID 126631899
11-[4-[2-[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]-4-[4-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole
CID 126630887
9-carbazol-9-yl-5-[7-(2-dibenzofuran-3-ylquinazolin-4-yl)naphthalen-2-yl]benzo[b]carbazole
CID 146375561
2-[9-(6-dibenzofuran-3-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole
CID 126753463
9-[3-[2,6-bis[4-[2,7-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]-2,7-bis(9-phenylcarbazol-3-yl)carbazole;9-[4-[2,4-bis[3-[2,7-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]quinazolin-6-yl]phenyl]-2,7-bis(9-phenylcarbazol-3-yl)carbazole
CID 160941783
7-[4-[2,6-bis[4-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]pyrimidin-4-yl]phenyl]-[1]benzofuro[2,3-b]carbazole;11-[3-[2,4-bis[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]quinazolin-6-yl]phenyl]-[1]benzofuro[3,2-b]carbazole
CID 159872734
9-[4-[2,6-bis[3-[3,6-bis(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]-3,6-bis(9-phenylcarbazol-2-yl)carbazole
CID 126630556
9-[4-[2,4-bis[4-(3-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-6-yl]phenyl]-3-dibenzofuran-3-ylcarbazole
CID 126631950
9-[3-[2,6-bis[4-[3,6-bis(9-phenylcarbazol-2-yl)carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]-3,6-bis(9-phenylcarbazol-2-yl)carbazole
CID 126630568

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole?
The IUPAC name of 2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole (CID 126631881) is 2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole.
What is the SMILES notation for 2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole?
The canonical SMILES for 2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole is c1cc(-c2ccc3nc(-c4cccc(-n5c6ccccc6c6ccc(-c7ccc8c(c7)oc7ccccc78)cc65)c4)nc(-c4ccc5cc(-n6c7ccccc7c7ccc(-c8ccc9c(c8)oc8ccccc89)cc76)ccc5c4)c3c2)cc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)oc4ccccc45)cc32)c1.
What is the InChIKey of 2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole?
The InChIKey is JFUWBEOBLIGEDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C102H59N5O3/c1-7-25-89-75(19-1)78-42-34-64(67-37-45-84-81-22-4-10-28-95(81)108-98(84)57-67)54-92(78)105(89)72-17-13-15-60(50-72)63-40-48-88-87(53-63)101(104-102(103-88)71-16-14-18-73(52-71)106-90-26-8-2-20-76(90)79-43-35-65(55-93(79)106)68-38-46-85-82-23-5-11-29-96(82)109-99(85)58-68)70-32-31-62-51-74(41-33-61(62)49-70)107-91-27-9-3-21-77(91)80-44-36-66(56-94(80)107)69-39-47-86-83-24-6-12-30-97(83)110-100(86)59-69/h1-59H.
What are the key properties of 2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole?
2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole has a molecular weight of 1402.63 g/mol, XLogP of 27.77, 9 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-3-yl-9-[3-[4-[6-(2-dibenzofuran-3-ylcarbazol-9-yl)naphthalen-2-yl]-6-[3-(2-dibenzofuran-3-ylcarbazol-9-yl)phenyl]quinazolin-2-yl]phenyl]carbazole is sourced from PubChem (CID 126631881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).