8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole

C167H103N13 — CID 159439696

IUPAC8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5ccccc5c5cc6ccc(-n7c8ccccc8c8ccc9ccccc9c87)cc6cc54)c4ccccc4n3)cc21.c1ccc(-n2c3ccccc3c3ccc(-c4nc(-n5c6ccccc6c6cc7ccc(-n8c9ccccc9c9ccc%10ccccc%10c98)cc7cc65)c5ccccc5n4)cc32)cc1.c1ccc2c(c1)ccc1ccc(-c3nc(-n4c5ccccc5c5cc6ccc(-n7c8ccccc8c8ccc9ccccc9c87)cc6cc54)c4ccccc4n3)cc12
InChIInChI=1S/C58H35N5.C55H36N4.C54H32N4/c1-2-15-40(16-3-1)61-51-23-11-7-18-43(51)46-30-28-38(34-54(46)61)57-59-50-22-10-6-21-48(50)58(60-57)63-53-25-13-9-20-45(53)49-33-37-26-29-41(32-39(37)35-55(49)63)62-52-24-12-8-19-44(52)47-31-27-36-14-4-5-17-42(36)56(47)62;1-55(2)46-19-9-5-15-39(46)40-27-25-35(31-47(40)55)53-56-48-20-10-6-18-44(48)54(57-53)59-50-22-12-8-17-42(50)45-30-34-23-26-37(29-36(34)32-51(45)59)58-49-21-11-7-16-41(49)43-28-24-33-13-3-4-14-38(33)52(43)58;1-3-13-40-33(11-1)21-22-35-23-24-37(31-46(35)40)53-55-48-18-8-5-17-45(48)54(56-53)58-50-20-10-7-16-43(50)47-30-36-25-27-39(29-38(36)32-51(47)58)57-49-19-9-6-15-42(49)44-28-26-34-12-2-4-14-41(34)52(44)57/h1-35H;3-32H,1-2H3;1-32H
InChIKeyLSAAUQVJASPGPB-UHFFFAOYSA-N
MW2291.75 g/mol
LogP43.10
Rot. Bonds10

About 8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole

8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole (PubChem CID 159439696) has the molecular formula C167H103N13 and a molecular weight of 2291.75 g/mol. Its IUPAC name is 8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole.

Molecular Properties

Compound Name8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole
PubChem CID159439696
Molecular FormulaC167H103N13
Molecular Weight2291.75 g/mol
Exact Mass2289.85
IUPAC Name8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5ccccc5c5cc6ccc(-n7c8ccccc8c8ccc9ccccc9c87)cc6cc54)c4ccccc4n3)cc21.c1ccc(-n2c3ccccc3c3ccc(-c4nc(-n5c6ccccc6c6cc7ccc(-n8c9ccccc9c9ccc%10ccccc%10c98)cc7cc65)c5ccccc5n4)cc32)cc1.c1ccc2c(c1)ccc1ccc(-c3nc(-n4c5ccccc5c5cc6ccc(-n7c8ccccc8c8ccc9ccccc9c87)cc6cc54)c4ccccc4n3)cc12
InChIInChI=1S/C58H35N5.C55H36N4.C54H32N4/c1-2-15-40(16-3-1)61-51-23-11-7-18-43(51)46-30-28-38(34-54(46)61)57-59-50-22-10-6-21-48(50)58(60-57)63-53-25-13-9-20-45(53)49-33-37-26-29-41(32-39(37)35-55(49)63)62-52-24-12-8-19-44(52)47-31-27-36-14-4-5-17-42(36)56(47)62;1-55(2)46-19-9-5-15-39(46)40-27-25-35(31-47(40)55)53-56-48-20-10-6-18-44(48)54(57-53)59-50-22-12-8-17-42(50)45-30-34-23-26-37(29-36(34)32-51(45)59)58-49-21-11-7-16-41(49)43-28-24-33-13-3-4-14-38(33)52(43)58;1-3-13-40-33(11-1)21-22-35-23-24-37(31-46(35)40)53-55-48-18-8-5-17-45(48)54(56-53)58-50-20-10-7-16-43(50)47-30-36-25-27-39(29-38(36)32-51(47)58)57-49-19-9-6-15-42(49)44-28-26-34-12-2-4-14-41(34)52(44)57/h1-35H;3-32H,1-2H3;1-32H
InChIKeyLSAAUQVJASPGPB-UHFFFAOYSA-N
XLogP43.10
TPSA111.85 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds10
Heavy Atoms180
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002291.75
LogP ≤ 543.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

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

Analyze 8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole with MolForge

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Related Compounds

8-benzo[a]carbazol-11-yl-5-[3-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]phenyl]benzo[b]carbazole
CID 146375702
5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole
CID 139361806
9-carbazol-9-yl-5-[4-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]naphthalen-1-yl]benzo[b]carbazole;9-carbazol-9-yl-5-[4-(4-phenanthren-3-ylquinazolin-2-yl)phenyl]benzo[b]carbazole;9-carbazol-9-yl-5-[5-[4-(9-phenylcarbazol-2-yl)quinazolin-2-yl]naphthalen-2-yl]benzo[b]carbazole
CID 158401705
16-[2,3-bis(9,9-dimethylfluoren-2-yl)quinoxalin-6-yl]-12-phenyl-12,16-diazahexacyclo[11.11.0.02,11.05,10.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 154952278
5-[2-(9,9-dimethylfluoren-3-yl)quinazolin-4-yl]benzo[b]carbazole
CID 139361545
8-benzo[c]carbazol-7-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole
CID 146375996
2-benzo[a]carbazol-11-yl-5-(2-naphthalen-2-ylquinazolin-4-yl)benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4-phenylphenyl)quinazolin-4-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-(2-phenylquinazolin-4-yl)benzo[b]carbazole
CID 157060055
2-[2-(6-benzo[b]carbazol-5-ylnaphthalen-2-yl)quinazolin-4-yl]-7-phenylbenzo[c]carbazole;3-[2-(4-benzo[b]carbazol-5-ylphenyl)quinazolin-4-yl]-7-phenylbenzo[c]carbazole;5-[3-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]naphthalen-1-yl]benzo[b]carbazole
CID 160512960
8-benzo[c]carbazol-7-yl-5-[3-(9,9-dimethylfluoren-2-yl)quinoxalin-2-yl]benzo[b]carbazole
CID 146375005
5-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]-3-(9-phenylcarbazol-3-yl)benzo[b]carbazole
CID 146874125
2-[2-(9,9-dimethylfluoren-2-yl)phenyl]-9-naphthalen-2-ylcarbazole
CID 129312240
5-[2-(9-naphthalen-2-ylcarbazol-3-yl)-7-phenylquinazolin-4-yl]-3-phenyl-9-[4-[3-[7-phenyl-4-(3-phenylbenzo[b]carbazol-5-yl)quinazolin-2-yl]carbazol-9-yl]phenyl]benzo[b]carbazole
CID 146539883

Frequently Asked Questions

What is the IUPAC name of 8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole?
The IUPAC name of 8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole (CID 159439696) is 8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole.
What is the SMILES notation for 8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole?
The canonical SMILES for 8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole is CC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5ccccc5c5cc6ccc(-n7c8ccccc8c8ccc9ccccc9c87)cc6cc54)c4ccccc4n3)cc21.c1ccc(-n2c3ccccc3c3ccc(-c4nc(-n5c6ccccc6c6cc7ccc(-n8c9ccccc9c9ccc%10ccccc%10c98)cc7cc65)c5ccccc5n4)cc32)cc1.c1ccc2c(c1)ccc1ccc(-c3nc(-n4c5ccccc5c5cc6ccc(-n7c8ccccc8c8ccc9ccccc9c87)cc6cc54)c4ccccc4n3)cc12.
What is the InChIKey of 8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole?
The InChIKey is LSAAUQVJASPGPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H35N5.C55H36N4.C54H32N4/c1-2-15-40(16-3-1)61-51-23-11-7-18-43(51)46-30-28-38(34-54(46)61)57-59-50-22-10-6-21-48(50)58(60-57)63-53-25-13-9-20-45(53)49-33-37-26-29-41(32-39(37)35-55(49)63)62-52-24-12-8-19-44(52)47-31-27-36-14-4-5-17-42(36)56(47)62;1-55(2)46-19-9-5-15-39(46)40-27-25-35(31-47(40)55)53-56-48-20-10-6-18-44(48)54(57-53)59-50-22-12-8-17-42(50)45-30-34-23-26-37(29-36(34)32-51(45)59)58-49-21-11-7-16-41(49)43-28-24-33-13-3-4-14-38(33)52(43)58;1-3-13-40-33(11-1)21-22-35-23-24-37(31-46(35)40)53-55-48-18-8-5-17-45(48)54(56-53)58-50-20-10-7-16-43(50)47-30-36-25-27-39(29-38(36)32-51(47)58)57-49-19-9-6-15-42(49)44-28-26-34-12-2-4-14-41(34)52(44)57/h1-35H;3-32H,1-2H3;1-32H.
What are the key properties of 8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole?
8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole has a molecular weight of 2291.75 g/mol, XLogP of 43.10, 10 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 8-benzo[a]carbazol-11-yl-5-[2-(9,9-dimethylfluoren-2-yl)quinazolin-4-yl]benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-(2-phenanthren-3-ylquinazolin-4-yl)benzo[b]carbazole;8-benzo[a]carbazol-11-yl-5-[2-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole is sourced from PubChem (CID 159439696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).