10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole

C186H110N12O — CID 158342873

IUPAC10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole
SMILESc1cc(-c2nc(-c3ccc4c(ccc5ccccc54)c3)c3ccccc3n2)cc(-n2c3ccccc3c3cc4c(-n5c6ccccc6c6ccc7ccccc7c65)cccc4cc32)c1.c1ccc2c(-n3c4ccccc4c4cc5c(-n6c7ccccc7c7ccc8ccccc8c76)cccc5cc43)cc(-c3nc(-c4cc5ccccc5c5ccccc45)c4ccccc4n3)cc2c1.c1ccc2c(-n3c4ccccc4c4cc5c(-n6c7ccccc7c7ccc8ccccc8c76)cccc5cc43)cc(-c3nc(-c4cccc5c4oc4ccccc45)c4ccccc4n3)cc2c1
InChIInChI=1S/C64H38N4.C62H36N4O.C60H36N4/c1-6-22-46-39(16-1)32-33-51-49-25-10-14-30-58(49)68(63(46)51)59-31-15-19-42-36-61-54(38-53(42)59)50-26-11-13-29-57(50)67(61)60-37-43(34-40-17-3-5-21-45(40)60)64-65-56-28-12-9-27-52(56)62(66-64)55-35-41-18-2-4-20-44(41)47-23-7-8-24-48(47)55;1-4-19-42-37(15-1)31-32-46-43-20-6-11-28-54(43)66(60(42)46)55-29-13-17-39-34-57-51(36-50(39)55)44-21-7-10-27-53(44)65(57)56-35-40(33-38-16-2-3-18-41(38)56)62-63-52-26-9-5-23-48(52)59(64-62)49-25-14-24-47-45-22-8-12-30-58(45)67-61(47)49;1-3-18-44-37(13-1)27-28-40-33-41(30-31-45(40)44)58-50-22-5-8-23-53(50)61-60(62-58)42-16-11-17-43(34-42)63-54-24-9-7-21-48(54)52-36-51-39(35-57(52)63)15-12-26-56(51)64-55-25-10-6-20-47(55)49-32-29-38-14-2-4-19-46(38)59(49)64/h1-38H;1-36H;1-36H
InChIKeyGRJGSSYOSMNILZ-UHFFFAOYSA-N
MW2529.01 g/mol
LogP49.21
Rot. Bonds12

About 10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole

10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole (PubChem CID 158342873) has the molecular formula C186H110N12O and a molecular weight of 2529.01 g/mol. Its IUPAC name is 10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole.

Molecular Properties

Compound Name10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole
PubChem CID158342873
Molecular FormulaC186H110N12O
Molecular Weight2529.01 g/mol
Exact Mass2526.89
IUPAC Name10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole
SMILESc1cc(-c2nc(-c3ccc4c(ccc5ccccc54)c3)c3ccccc3n2)cc(-n2c3ccccc3c3cc4c(-n5c6ccccc6c6ccc7ccccc7c65)cccc4cc32)c1.c1ccc2c(-n3c4ccccc4c4cc5c(-n6c7ccccc7c7ccc8ccccc8c76)cccc5cc43)cc(-c3nc(-c4cc5ccccc5c5ccccc45)c4ccccc4n3)cc2c1.c1ccc2c(-n3c4ccccc4c4cc5c(-n6c7ccccc7c7ccc8ccccc8c76)cccc5cc43)cc(-c3nc(-c4cccc5c4oc4ccccc45)c4ccccc4n3)cc2c1
InChIInChI=1S/C64H38N4.C62H36N4O.C60H36N4/c1-6-22-46-39(16-1)32-33-51-49-25-10-14-30-58(49)68(63(46)51)59-31-15-19-42-36-61-54(38-53(42)59)50-26-11-13-29-57(50)67(61)60-37-43(34-40-17-3-5-21-45(40)60)64-65-56-28-12-9-27-52(56)62(66-64)55-35-41-18-2-4-20-44(41)47-23-7-8-24-48(47)55;1-4-19-42-37(15-1)31-32-46-43-20-6-11-28-54(43)66(60(42)46)55-29-13-17-39-34-57-51(36-50(39)55)44-21-7-10-27-53(44)65(57)56-35-40(33-38-16-2-3-18-41(38)56)62-63-52-26-9-5-23-48(52)59(64-62)49-25-14-24-47-45-22-8-12-30-58(45)67-61(47)49;1-3-18-44-37(13-1)27-28-40-33-41(30-31-45(40)44)58-50-22-5-8-23-53(50)61-60(62-58)42-16-11-17-43(34-42)63-54-24-9-7-21-48(54)52-36-51-39(35-57(52)63)15-12-26-56(51)64-55-25-10-6-20-47(55)49-32-29-38-14-2-4-19-46(38)59(49)64/h1-38H;1-36H;1-36H
InChIKeyGRJGSSYOSMNILZ-UHFFFAOYSA-N
XLogP49.21
TPSA120.06 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds12
Heavy Atoms199
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002529.01
LogP ≤ 549.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole with MolForge

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Related Compounds

9-benzo[a]carbazol-11-yl-5-[5-(4-dibenzofuran-3-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole
CID 146375982
12-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)phenyl]-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 129149698
12-[3-(4-phenanthren-9-ylquinazolin-2-yl)phenyl]-12-azapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaene
CID 139362039
5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole
CID 139362132
12-[6-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-2-yl]-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaene
CID 139362069
5-[3-(4-phenanthren-9-ylquinazolin-2-yl)phenyl]benzo[b]carbazole
CID 139362117
2-benzo[a]carbazol-11-yl-5-[3-(4-phenylquinazolin-2-yl)phenyl]benzo[b]carbazole
CID 146375421
26-naphthalen-1-yl-15-[4-(4-phenylquinazolin-2-yl)phenyl]-4-oxa-15,26-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 126677772
11-dibenzofuran-4-yl-8-[9-(3-phenylphenyl)carbazol-3-yl]benzo[a]carbazole
CID 167243675
2-[9-(6-dibenzofuran-4-ylnaphthalen-1-yl)carbazol-2-yl]-9-phenylcarbazole
CID 126753605
15-naphthalen-1-yl-24-(4-phenylphenyl)-4-oxa-15,24-diazaheptacyclo[14.11.0.02,14.03,11.05,10.017,25.018,23]heptacosa-1(16),2(14),3(11),5,7,9,12,17(25),18,20,22,26-dodecaene;24-naphthalen-1-yl-15-(4-phenylphenyl)-4-oxa-15,24-diazaheptacyclo[14.11.0.02,14.03,11.05,10.017,25.018,23]heptacosa-1(16),2(14),3(11),5,7,9,12,17(25),18,20,22,26-dodecaene;15-naphthalen-1-yl-4-[4-(4-phenylquinazolin-2-yl)phenyl]-24-oxa-4,15-diazaheptacyclo[14.11.0.02,14.03,11.05,10.017,25.018,23]heptacosa-1(16),2(14),3(11),5,7,9,12,17(25),18,20,22,26-dodecaene
CID 159901266
8-(9-dibenzofuran-4-ylcarbazol-3-yl)-11-(3-phenylphenyl)benzo[a]carbazole
CID 167243442

Frequently Asked Questions

What is the IUPAC name of 10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole?
The IUPAC name of 10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole (CID 158342873) is 10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole.
What is the SMILES notation for 10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole?
The canonical SMILES for 10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole is c1cc(-c2nc(-c3ccc4c(ccc5ccccc54)c3)c3ccccc3n2)cc(-n2c3ccccc3c3cc4c(-n5c6ccccc6c6ccc7ccccc7c65)cccc4cc32)c1.c1ccc2c(-n3c4ccccc4c4cc5c(-n6c7ccccc7c7ccc8ccccc8c76)cccc5cc43)cc(-c3nc(-c4cc5ccccc5c5ccccc45)c4ccccc4n3)cc2c1.c1ccc2c(-n3c4ccccc4c4cc5c(-n6c7ccccc7c7ccc8ccccc8c76)cccc5cc43)cc(-c3nc(-c4cccc5c4oc4ccccc45)c4ccccc4n3)cc2c1.
What is the InChIKey of 10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole?
The InChIKey is GRJGSSYOSMNILZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H38N4.C62H36N4O.C60H36N4/c1-6-22-46-39(16-1)32-33-51-49-25-10-14-30-58(49)68(63(46)51)59-31-15-19-42-36-61-54(38-53(42)59)50-26-11-13-29-57(50)67(61)60-37-43(34-40-17-3-5-21-45(40)60)64-65-56-28-12-9-27-52(56)62(66-64)55-35-41-18-2-4-20-44(41)47-23-7-8-24-48(47)55;1-4-19-42-37(15-1)31-32-46-43-20-6-11-28-54(43)66(60(42)46)55-29-13-17-39-34-57-51(36-50(39)55)44-21-7-10-27-53(44)65(57)56-35-40(33-38-16-2-3-18-41(38)56)62-63-52-26-9-5-23-48(52)59(64-62)49-25-14-24-47-45-22-8-12-30-58(45)67-61(47)49;1-3-18-44-37(13-1)27-28-40-33-41(30-31-45(40)44)58-50-22-5-8-23-53(50)61-60(62-58)42-16-11-17-43(34-42)63-54-24-9-7-21-48(54)52-36-51-39(35-57(52)63)15-12-26-56(51)64-55-25-10-6-20-47(55)49-32-29-38-14-2-4-19-46(38)59(49)64/h1-38H;1-36H;1-36H.
What are the key properties of 10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole?
10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole has a molecular weight of 2529.01 g/mol, XLogP of 49.21, 12 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 10-benzo[a]carbazol-11-yl-5-[3-(4-dibenzofuran-4-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-ylquinazolin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-2-ylquinazolin-2-yl)phenyl]benzo[b]carbazole is sourced from PubChem (CID 158342873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).