5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole

C329H204N24S — CID 157365612

IUPAC5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5ccccc5c5ccc(-c6cc7c8ccccc8n(-c8ccccc8)c7c7ccccc67)cc54)nc4ccccc34)cc21.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7cc8ccccc8c8ccccc78)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7ccc8ccccc8c7)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7cccc(-c8cccc9ccccc89)c7)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7cccc8c7sc7ccccc78)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7cccc8ccccc78)c7ccccc7n6)c5c4)c4ccccc4c32)cc1
InChIInChI=1S/C58H36N4.C57H38N4.C56H34N4.C54H32N4S.2C52H32N4/c1-2-20-41(21-3-1)61-53-30-12-10-25-46(53)51-36-50(44-23-6-7-26-48(44)57(51)61)39-32-33-47-45-24-9-13-31-54(45)62(55(47)35-39)58-59-52-29-11-8-27-49(52)56(60-58)40-19-14-18-38(34-40)43-28-15-17-37-16-4-5-22-42(37)43;1-57(2)48-24-12-8-19-39(48)40-30-29-36(32-49(40)57)54-45-23-9-13-25-50(45)58-56(59-54)61-52-27-15-10-20-41(52)43-31-28-35(33-53(43)61)46-34-47-42-21-11-14-26-51(42)60(37-16-4-3-5-17-37)55(47)44-22-7-6-18-38(44)46;1-2-17-37(18-3-1)59-51-28-14-12-24-43(51)49-34-47(41-22-8-9-25-45(41)55(49)59)36-30-31-44-42-23-11-15-29-52(42)60(53(44)33-36)56-57-50-27-13-10-26-46(50)54(58-56)48-32-35-16-4-5-19-38(35)39-20-6-7-21-40(39)48;1-2-15-34(16-3-1)57-47-26-11-8-19-37(47)45-32-44(35-17-4-5-21-40(35)52(45)57)33-29-30-38-36-18-7-12-27-48(36)58(49(38)31-33)54-55-46-25-10-6-22-42(46)51(56-54)43-24-14-23-41-39-20-9-13-28-50(39)59-53(41)43;1-2-17-35(18-3-1)55-47-27-12-10-22-39(47)45-32-44(37-20-6-7-23-42(37)51(45)55)34-29-30-40-38-21-9-13-28-48(38)56(49(40)31-34)52-53-46-26-11-8-24-43(46)50(54-52)41-25-14-16-33-15-4-5-19-36(33)41;1-2-16-37(17-3-1)55-47-24-12-10-20-40(47)45-32-44(38-18-6-7-21-42(38)51(45)55)35-28-29-41-39-19-9-13-25-48(39)56(49(41)31-35)52-53-46-23-11-8-22-43(46)50(54-52)36-27-26-33-14-4-5-15-34(33)30-36/h1-36H;3-34H,1-2H3;1-34H;1-32H;2*1-32H
InChIKeyBJDHOVBNLDJKGA-UHFFFAOYSA-N
MW4525.49 g/mol
LogP85.97
Rot. Bonds25

About 5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole

5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole (PubChem CID 157365612) has the molecular formula C329H204N24S and a molecular weight of 4525.49 g/mol. Its IUPAC name is 5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole.

Molecular Properties

Compound Name5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole
PubChem CID157365612
Molecular FormulaC329H204N24S
Molecular Weight4525.49 g/mol
Exact Mass4521.64
IUPAC Name5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5ccccc5c5ccc(-c6cc7c8ccccc8n(-c8ccccc8)c7c7ccccc67)cc54)nc4ccccc34)cc21.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7cc8ccccc8c8ccccc78)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7ccc8ccccc8c7)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7cccc(-c8cccc9ccccc89)c7)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7cccc8c7sc7ccccc78)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7cccc8ccccc78)c7ccccc7n6)c5c4)c4ccccc4c32)cc1
InChIInChI=1S/C58H36N4.C57H38N4.C56H34N4.C54H32N4S.2C52H32N4/c1-2-20-41(21-3-1)61-53-30-12-10-25-46(53)51-36-50(44-23-6-7-26-48(44)57(51)61)39-32-33-47-45-24-9-13-31-54(45)62(55(47)35-39)58-59-52-29-11-8-27-49(52)56(60-58)40-19-14-18-38(34-40)43-28-15-17-37-16-4-5-22-42(37)43;1-57(2)48-24-12-8-19-39(48)40-30-29-36(32-49(40)57)54-45-23-9-13-25-50(45)58-56(59-54)61-52-27-15-10-20-41(52)43-31-28-35(33-53(43)61)46-34-47-42-21-11-14-26-51(42)60(37-16-4-3-5-17-37)55(47)44-22-7-6-18-38(44)46;1-2-17-37(18-3-1)59-51-28-14-12-24-43(51)49-34-47(41-22-8-9-25-45(41)55(49)59)36-30-31-44-42-23-11-15-29-52(42)60(53(44)33-36)56-57-50-27-13-10-26-46(50)54(58-56)48-32-35-16-4-5-19-38(35)39-20-6-7-21-40(39)48;1-2-15-34(16-3-1)57-47-26-11-8-19-37(47)45-32-44(35-17-4-5-21-40(35)52(45)57)33-29-30-38-36-18-7-12-27-48(36)58(49(38)31-33)54-55-46-25-10-6-22-42(46)51(56-54)43-24-14-23-41-39-20-9-13-28-50(39)59-53(41)43;1-2-17-35(18-3-1)55-47-27-12-10-22-39(47)45-32-44(37-20-6-7-23-42(37)51(45)55)34-29-30-40-38-21-9-13-28-48(38)56(49(40)31-34)52-53-46-26-11-8-24-43(46)50(54-52)41-25-14-16-33-15-4-5-19-36(33)41;1-2-16-37(17-3-1)55-47-24-12-10-20-40(47)45-32-44(38-18-6-7-21-42(38)51(45)55)35-28-29-41-39-19-9-13-25-48(39)56(49(41)31-35)52-53-46-23-11-8-22-43(46)50(54-52)36-27-26-33-14-4-5-15-34(33)30-36/h1-36H;3-34H,1-2H3;1-34H;1-32H;2*1-32H
InChIKeyBJDHOVBNLDJKGA-UHFFFAOYSA-N
XLogP85.97
TPSA213.84 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds25
Heavy Atoms354
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004525.49
LogP ≤ 585.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Analyze 5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole with MolForge

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Related Compounds

5-[11-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[a]carbazol-5-yl]-11-phenylbenzo[a]carbazole;5-[11-(4-naphthalen-1-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-11-phenylbenzo[a]carbazole;5-(11-phenylbenzo[a]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole
CID 159898026
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
2-(11,11-dimethylbenzo[a]fluoren-3-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-(3-naphtho[1,2-b][1]benzothiol-4-ylphenyl)-6-phenyl-1,3,5-triazine;11-phenyl-4-[4-(4-phenylquinazolin-2-yl)naphthalen-1-yl]benzo[a]carbazole
CID 158833817
2-dibenzothiophen-4-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole
CID 131979694
9-[4-[5-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]phenyl]phenanthrene;12-(4,6-diphenyl-2-pyridinyl)-[1]benzothiolo[2,3-a]carbazole;3-(4,6-diphenyl-1,3,5-triazin-2-yl)-24-phenyl-3,24-diazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene;molecular hydrogen;9-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]phenanthrene;15-phenyl-12-(4-phenylquinazolin-2-yl)-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene
CID 162102666
9-[4-[5-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]phenyl]phenanthrene;10-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-3,4-dihydrophenanthrene;2-phenyl-7-(3-phenylphenyl)triphenylene;15-phenyl-12-(4-phenylquinazolin-2-yl)-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene;2-triphenylen-2-yldibenzofuran;4-(3-triphenylen-2-ylphenyl)dibenzothiophene
CID 157145642
9-benzo[b]carbazol-5-yl-5-(4-dibenzothiophen-4-ylquinazolin-2-yl)benzo[b]carbazole;9-benzo[b]carbazol-5-yl-5-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[b]carbazole;9-benzo[b]carbazol-5-yl-5-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]benzo[b]carbazole
CID 159019157
4-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-26-phenyl-15-thia-4,26-diazaheptacyclo[14.11.0.02,14.03,11.05,10.019,27.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19(27),20,22,24-dodecaene;4-phenyl-26-[4-(4-phenylnaphthalen-1-yl)quinazolin-2-yl]-15-thia-4,26-diazaheptacyclo[14.11.0.02,14.03,11.05,10.019,27.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19(27),20,22,24-dodecaene;4-phenyl-26-[4-(7-phenylnaphthalen-2-yl)quinazolin-2-yl]-15-thia-4,26-diazaheptacyclo[14.11.0.02,14.03,11.05,10.019,27.020,25]heptacosa-1(16),2(14),3(11),5,7,9,12,17,19(27),20,22,24-dodecaene
CID 158261971
12-(9,9-dimethylfluoren-2-yl)-16-(4-phenylquinazolin-2-yl)-12,16-diazahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(13),2,4,6,8,10,14,17,19,21,23-undecaene;16-(4-naphthalen-1-ylquinazolin-2-yl)-12-phenyl-12,16-diazahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(13),2,4,6,8,10,14,17,19,21,23-undecaene;16-(4-naphthalen-2-ylquinazolin-2-yl)-12-phenyl-12,16-diazahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(13),2,4,6,8,10,14,17,19,21,23-undecaene
CID 158538438
11-(9,9-dimethylfluoren-2-yl)-5-[9-(4-phenylquinazolin-2-yl)carbazol-3-yl]benzo[a]carbazole
CID 118637348
5-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-3-yl)benzo[b]carbazole
CID 146874125
3-[9-(4-dibenzothiophen-3-ylquinazolin-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)quinazolin-2-yl]carbazole
CID 165104887

Frequently Asked Questions

What is the IUPAC name of 5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole?
The IUPAC name of 5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole (CID 157365612) is 5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole.
What is the SMILES notation for 5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole?
The canonical SMILES for 5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole is CC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5ccccc5c5ccc(-c6cc7c8ccccc8n(-c8ccccc8)c7c7ccccc67)cc54)nc4ccccc34)cc21.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7cc8ccccc8c8ccccc78)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7ccc8ccccc8c7)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7cccc(-c8cccc9ccccc89)c7)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7cccc8c7sc7ccccc78)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c6ccccc6n(-c6nc(-c7cccc8ccccc78)c7ccccc7n6)c5c4)c4ccccc4c32)cc1.
What is the InChIKey of 5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole?
The InChIKey is BJDHOVBNLDJKGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H36N4.C57H38N4.C56H34N4.C54H32N4S.2C52H32N4/c1-2-20-41(21-3-1)61-53-30-12-10-25-46(53)51-36-50(44-23-6-7-26-48(44)57(51)61)39-32-33-47-45-24-9-13-31-54(45)62(55(47)35-39)58-59-52-29-11-8-27-49(52)56(60-58)40-19-14-18-38(34-40)43-28-15-17-37-16-4-5-22-42(37)43;1-57(2)48-24-12-8-19-39(48)40-30-29-36(32-49(40)57)54-45-23-9-13-25-50(45)58-56(59-54)61-52-27-15-10-20-41(52)43-31-28-35(33-53(43)61)46-34-47-42-21-11-14-26-51(42)60(37-16-4-3-5-17-37)55(47)44-22-7-6-18-38(44)46;1-2-17-37(18-3-1)59-51-28-14-12-24-43(51)49-34-47(41-22-8-9-25-45(41)55(49)59)36-30-31-44-42-23-11-15-29-52(42)60(53(44)33-36)56-57-50-27-13-10-26-46(50)54(58-56)48-32-35-16-4-5-19-38(35)39-20-6-7-21-40(39)48;1-2-15-34(16-3-1)57-47-26-11-8-19-37(47)45-32-44(35-17-4-5-21-40(35)52(45)57)33-29-30-38-36-18-7-12-27-48(36)58(49(38)31-33)54-55-46-25-10-6-22-42(46)51(56-54)43-24-14-23-41-39-20-9-13-28-50(39)59-53(41)43;1-2-17-35(18-3-1)55-47-27-12-10-22-39(47)45-32-44(37-20-6-7-23-42(37)51(45)55)34-29-30-40-38-21-9-13-28-48(38)56(49(40)31-34)52-53-46-26-11-8-24-43(46)50(54-52)41-25-14-16-33-15-4-5-19-36(33)41;1-2-16-37(17-3-1)55-47-24-12-10-20-40(47)45-32-44(38-18-6-7-21-42(38)51(45)55)35-28-29-41-39-19-9-13-25-48(39)56(49(41)31-35)52-53-46-23-11-8-22-43(46)50(54-52)36-27-26-33-14-4-5-15-34(33)30-36/h1-36H;3-34H,1-2H3;1-34H;1-32H;2*1-32H.
What are the key properties of 5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole?
5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole has a molecular weight of 4525.49 g/mol, XLogP of 85.97, 25 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[9-(4-dibenzothiophen-4-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-[4-(3-naphthalen-1-ylphenyl)quinazolin-2-yl]carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-1-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-naphthalen-2-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole;5-[9-(4-phenanthren-9-ylquinazolin-2-yl)carbazol-2-yl]-11-phenylbenzo[a]carbazole is sourced from PubChem (CID 157365612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).