5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole

C168H101N13OS — CID 162105305

IUPAC5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7ccc8oc9ccccc9c8c7)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7ccc8sc9ccccc9c8c7)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4nc(-n5c6ccccc6c6ccc(-c7cc8c9ccccc9n(-c9ccccc9)c8c8ccccc78)cc65)nc5ccccc45)ccc32)cc1
InChIInChI=1S/C60H37N5.C54H32N4O.C54H32N4S/c1-3-17-40(18-4-1)63-53-28-14-11-23-44(53)50-35-39(32-34-56(50)63)58-48-26-9-13-27-52(48)61-60(62-58)65-55-30-16-10-22-43(55)46-33-31-38(36-57(46)65)49-37-51-45-24-12-15-29-54(45)64(41-19-5-2-6-20-41)59(51)47-25-8-7-21-42(47)49;2*1-2-14-35(15-3-1)57-47-23-11-8-18-38(47)45-32-43(36-16-4-5-20-41(36)53(45)57)33-26-28-39-37-17-7-12-24-48(37)58(49(39)31-33)54-55-46-22-10-6-21-42(46)52(56-54)34-27-29-51-44(30-34)40-19-9-13-25-50(40)59-51/h1-37H;2*1-32H
InChIKeyZFKSLTFSWJGSSF-UHFFFAOYSA-N
MW2349.81 g/mol
LogP44.30
Rot. Bonds13

About 5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole

5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole (PubChem CID 162105305) has the molecular formula C168H101N13OS and a molecular weight of 2349.81 g/mol. Its IUPAC name is 5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole.

Molecular Properties

Compound Name5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole
PubChem CID162105305
Molecular FormulaC168H101N13OS
Molecular Weight2349.81 g/mol
Exact Mass2347.80
IUPAC Name5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7ccc8oc9ccccc9c8c7)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7ccc8sc9ccccc9c8c7)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4nc(-n5c6ccccc6c6ccc(-c7cc8c9ccccc9n(-c9ccccc9)c8c8ccccc78)cc65)nc5ccccc45)ccc32)cc1
InChIInChI=1S/C60H37N5.C54H32N4O.C54H32N4S/c1-3-17-40(18-4-1)63-53-28-14-11-23-44(53)50-35-39(32-34-56(50)63)58-48-26-9-13-27-52(48)61-60(62-58)65-55-30-16-10-22-43(55)46-33-31-38(36-57(46)65)49-37-51-45-24-12-15-29-54(45)64(41-19-5-2-6-20-41)59(51)47-25-8-7-21-42(47)49;2*1-2-14-35(15-3-1)57-47-23-11-8-18-38(47)45-32-43(36-16-4-5-20-41(36)53(45)57)33-26-28-39-37-17-7-12-24-48(37)58(49(39)31-33)54-55-46-22-10-6-21-42(46)52(56-54)34-27-29-51-44(30-34)40-19-9-13-25-50(40)59-51/h1-37H;2*1-32H
InChIKeyZFKSLTFSWJGSSF-UHFFFAOYSA-N
XLogP44.30
TPSA124.99 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds13
Heavy Atoms183
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002349.81
LogP ≤ 544.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole with MolForge

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Related Compounds

5-[11-(4-dibenzofuran-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-11-phenylbenzo[a]carbazole
CID 134353213
11-(4-dibenzofuran-2-ylquinazolin-2-yl)-5-(9-phenylcarbazol-2-yl)benzo[a]carbazole;11-(4-dibenzofuran-4-ylquinazolin-2-yl)-5-(9-phenylcarbazol-2-yl)benzo[a]carbazole;11-(4-dibenzothiophen-2-ylquinazolin-2-yl)-5-(9-phenylcarbazol-2-yl)benzo[a]carbazole;11-(4-dibenzothiophen-4-ylquinazolin-2-yl)-5-(9-phenylcarbazol-2-yl)benzo[a]carbazole;11-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-5-(9-phenylcarbazol-2-yl)benzo[a]carbazole;5-(9-phenylcarbazol-2-yl)-11-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]benzo[a]carbazole
CID 159284497
3-carbazol-9-yl-9-[4-[7-[4-[2-(3-carbazol-9-ylcarbazol-9-yl)-4-dibenzothiophen-2-ylquinazolin-7-yl]phenyl]dibenzofuran-2-yl]quinazolin-2-yl]carbazole
CID 139315619
3-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 130355720
3-[9-(4-tert-butylquinazolin-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-2-yl-6-phenyl-9-(4-phenylquinazolin-2-yl)carbazole;3-dibenzothiophen-2-yl-6-phenyl-9-(4-phenylquinazolin-2-yl)carbazole
CID 161282995
10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)-[1]benzothiolo[2,3-b]carbazole
CID 138475168
3-dibenzofuran-2-yl-9-[4-(3-phenylphenyl)quinazolin-2-yl]carbazole;3-dibenzothiophen-2-yl-9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazole;3-dibenzothiophen-2-yl-9-[4-[3-(4-phenylphenyl)phenyl]quinazolin-2-yl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[4-[3-(4-phenylphenyl)phenyl]quinazolin-2-yl]carbazole
CID 158788223
CID 160619323
CID 160619323
3-dibenzofuran-2-yl-9-phenylcarbazole;3-dibenzothiophen-2-yl-9-phenylcarbazole;3-dibenzothiophen-2-yl-9-(3-phenylphenyl)carbazole;9-phenyl-2-(9-phenylcarbazol-3-yl)carbazole
CID 157163023
9-dibenzofuran-2-yl-3-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]carbazole;9-dibenzothiophen-2-yl-3-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]carbazole;2-(9-phenylcarbazol-3-yl)-9-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 157326935
3-dibenzofuran-2-yl-6-dibenzothiophen-2-yl-9-phenylcarbazole
CID 122451698
9-dibenzofuran-2-yl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-dibenzothiophen-2-yl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3,6,9-tris(9-phenylcarbazol-3-yl)carbazole
CID 161382413

Frequently Asked Questions

What is the IUPAC name of 5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole?
The IUPAC name of 5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole (CID 162105305) is 5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole.
What is the SMILES notation for 5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole?
The canonical SMILES for 5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole is c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7ccc8oc9ccccc9c8c7)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7ccc8sc9ccccc9c8c7)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4nc(-n5c6ccccc6c6ccc(-c7cc8c9ccccc9n(-c9ccccc9)c8c8ccccc78)cc65)nc5ccccc45)ccc32)cc1.
What is the InChIKey of 5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole?
The InChIKey is ZFKSLTFSWJGSSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H37N5.C54H32N4O.C54H32N4S/c1-3-17-40(18-4-1)63-53-28-14-11-23-44(53)50-35-39(32-34-56(50)63)58-48-26-9-13-27-52(48)61-60(62-58)65-55-30-16-10-22-43(55)46-33-31-38(36-57(46)65)49-37-51-45-24-12-15-29-54(45)64(41-19-5-2-6-20-41)59(51)47-25-8-7-21-42(47)49;2*1-2-14-35(15-3-1)57-47-23-11-8-18-38(47)45-32-43(36-16-4-5-20-41(36)53(45)57)33-26-28-39-37-17-7-12-24-48(37)58(49(39)31-33)54-55-46-22-10-6-21-42(46)52(56-54)34-27-29-51-44(30-34)40-19-9-13-25-50(40)59-51/h1-37H;2*1-32H.
What are the key properties of 5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole?
5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole has a molecular weight of 2349.81 g/mol, XLogP of 44.30, 13 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[9-(4-dibenzofuran-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-dibenzothiophen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;11-phenyl-5-[9-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]carbazol-2-yl]benzo[a]carbazole is sourced from PubChem (CID 162105305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).