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

C165H101N13S — CID 159019157

IUPAC9-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
SMILESCC1(C)c2ccccc2-c2cccc(-c3nc(-n4c5ccccc5c5cc6cc(-n7c8ccccc8c8cc9ccccc9cc87)ccc6cc54)nc4ccccc34)c21.c1ccc(-n2c3ccccc3c3cc(-c4nc(-n5c6ccccc6c6cc7cc(-n8c9ccccc9c9cc%10ccccc%10cc98)ccc7cc65)nc5ccccc45)ccc32)cc1.c1ccc2cc3c(cc2c1)c1ccccc1n3-c1ccc2cc3c(cc2c1)c1ccccc1n3-c1nc(-c2cccc3c2sc2ccccc23)c2ccccc2n1
InChIInChI=1S/C58H35N5.C55H36N4.C52H30N4S/c1-2-16-41(17-3-1)61-51-23-11-7-18-43(51)47-32-39(27-29-54(47)61)57-46-21-6-10-22-50(46)59-58(60-57)63-53-25-13-9-20-45(53)49-33-40-30-42(28-26-38(40)35-56(49)63)62-52-24-12-8-19-44(52)48-31-36-14-4-5-15-37(36)34-55(48)62;1-55(2)46-22-9-5-16-38(46)41-20-13-21-43(52(41)55)53-42-19-6-10-23-47(42)56-54(57-53)59-49-25-12-8-18-40(49)45-30-36-28-37(27-26-35(36)32-51(45)59)58-48-24-11-7-17-39(48)44-29-33-14-3-4-15-34(33)31-50(44)58;1-2-13-32-29-47-42(27-31(32)12-1)36-14-4-8-21-45(36)55(47)35-25-24-33-30-48-43(28-34(33)26-35)37-15-5-9-22-46(37)56(48)52-53-44-20-7-3-17-40(44)50(54-52)41-19-11-18-39-38-16-6-10-23-49(38)57-51(39)41/h1-35H;3-32H,1-2H3;1-30H
InChIKeyJTLVRFDXVZIITF-UHFFFAOYSA-N
MW2297.78 g/mol
LogP43.16
Rot. Bonds10

About 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

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 (PubChem CID 159019157) has the molecular formula C165H101N13S and a molecular weight of 2297.78 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name9-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
PubChem CID159019157
Molecular FormulaC165H101N13S
Molecular Weight2297.78 g/mol
Exact Mass2295.80
IUPAC Name9-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
SMILESCC1(C)c2ccccc2-c2cccc(-c3nc(-n4c5ccccc5c5cc6cc(-n7c8ccccc8c8cc9ccccc9cc87)ccc6cc54)nc4ccccc34)c21.c1ccc(-n2c3ccccc3c3cc(-c4nc(-n5c6ccccc6c6cc7cc(-n8c9ccccc9c9cc%10ccccc%10cc98)ccc7cc65)nc5ccccc45)ccc32)cc1.c1ccc2cc3c(cc2c1)c1ccccc1n3-c1ccc2cc3c(cc2c1)c1ccccc1n3-c1nc(-c2cccc3c2sc2ccccc23)c2ccccc2n1
InChIInChI=1S/C58H35N5.C55H36N4.C52H30N4S/c1-2-16-41(17-3-1)61-51-23-11-7-18-43(51)47-32-39(27-29-54(47)61)57-46-21-6-10-22-50(46)59-58(60-57)63-53-25-13-9-20-45(53)49-33-40-30-42(28-26-38(40)35-56(49)63)62-52-24-12-8-19-44(52)48-31-36-14-4-5-15-37(36)34-55(48)62;1-55(2)46-22-9-5-16-38(46)41-20-13-21-43(52(41)55)53-42-19-6-10-23-47(42)56-54(57-53)59-49-25-12-8-18-40(49)45-30-36-28-37(27-26-35(36)32-51(45)59)58-48-24-11-7-17-39(48)44-29-33-14-3-4-15-34(33)31-50(44)58;1-2-13-32-29-47-42(27-31(32)12-1)36-14-4-8-21-45(36)55(47)35-25-24-33-30-48-43(28-34(33)26-35)37-15-5-9-22-46(37)56(48)52-53-44-20-7-3-17-40(44)50(54-52)41-19-11-18-39-38-16-6-10-23-49(38)57-51(39)41/h1-35H;3-32H,1-2H3;1-30H
InChIKeyJTLVRFDXVZIITF-UHFFFAOYSA-N
XLogP43.16
TPSA111.85 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds10
Heavy Atoms179
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002297.78
LogP ≤ 543.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 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 with MolForge

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Related Compounds

10-carbazol-9-yl-5-(3-dibenzothiophen-4-ylquinoxalin-2-yl)benzo[b]carbazole;10-carbazol-9-yl-5-[3-(9,9-dimethylfluoren-1-yl)quinoxalin-2-yl]benzo[b]carbazole;10-carbazol-9-yl-5-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]benzo[b]carbazole
CID 159535405
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
5-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-3-yl)benzo[b]carbazole
CID 146874125
5-[6-(2-dibenzothiophen-4-ylquinazolin-4-yl)naphthalen-2-yl]benzo[b]carbazole
CID 139362260
2-dibenzothiophen-4-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole
CID 131979694
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
5-[4-(9,9-dimethylfluoren-1-yl)-6-phenylquinazolin-2-yl]benzo[b]carbazole
CID 139362284
10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole
CID 163797018
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
3-carbazol-9-yl-5-[4-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]phenyl]benzo[b]carbazole
CID 146375384
9-anthracen-2-yl-3-dibenzothiophen-4-ylcarbazole
CID 87156475
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

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC1(C)c2ccccc2-c2cccc(-c3nc(-n4c5ccccc5c5cc6cc(-n7c8ccccc8c8cc9ccccc9cc87)ccc6cc54)nc4ccccc34)c21.c1ccc(-n2c3ccccc3c3cc(-c4nc(-n5c6ccccc6c6cc7cc(-n8c9ccccc9c9cc%10ccccc%10cc98)ccc7cc65)nc5ccccc45)ccc32)cc1.c1ccc2cc3c(cc2c1)c1ccccc1n3-c1ccc2cc3c(cc2c1)c1ccccc1n3-c1nc(-c2cccc3c2sc2ccccc23)c2ccccc2n1.
What is the InChIKey of 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?
The InChIKey is JTLVRFDXVZIITF-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H35N5.C55H36N4.C52H30N4S/c1-2-16-41(17-3-1)61-51-23-11-7-18-43(51)47-32-39(27-29-54(47)61)57-46-21-6-10-22-50(46)59-58(60-57)63-53-25-13-9-20-45(53)49-33-40-30-42(28-26-38(40)35-56(49)63)62-52-24-12-8-19-44(52)48-31-36-14-4-5-15-37(36)34-55(48)62;1-55(2)46-22-9-5-16-38(46)41-20-13-21-43(52(41)55)53-42-19-6-10-23-47(42)56-54(57-53)59-49-25-12-8-18-40(49)45-30-36-28-37(27-26-35(36)32-51(45)59)58-48-24-11-7-17-39(48)44-29-33-14-3-4-15-34(33)31-50(44)58;1-2-13-32-29-47-42(27-31(32)12-1)36-14-4-8-21-45(36)55(47)35-25-24-33-30-48-43(28-34(33)26-35)37-15-5-9-22-46(37)56(48)52-53-44-20-7-3-17-40(44)50(54-52)41-19-11-18-39-38-16-6-10-23-49(38)57-51(39)41/h1-35H;3-32H,1-2H3;1-30H.
What are the key properties of 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?
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 has a molecular weight of 2297.78 g/mol, XLogP of 43.16, 10 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 159019157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).