5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole

C114H70N8 — CID 158169302

IUPAC5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole
SMILESc1ccc(-c2cccc(-c3nc(-n4c5ccccc5c5cc(-c6cc7c(c8ccccc68)c6ccccc6n7-c6ccccc6)c6ccccc6c54)nc4ccccc34)c2)cc1.c1ccc(-n2c3ccccc3c3c4ccccc4c(-c4cc5c6ccccc6n(-c6nc(-c7ccc8ccccc8c7)c7ccccc7n6)c5c5ccccc45)cc32)cc1
InChIInChI=1S/C58H36N4.C56H34N4/c1-3-18-37(19-4-1)38-20-17-21-39(34-38)56-46-29-11-14-31-51(46)59-58(60-56)62-52-32-15-12-26-43(52)50-35-48(42-25-8-10-28-45(42)57(50)62)49-36-54-55(44-27-9-7-24-41(44)49)47-30-13-16-33-53(47)61(54)40-22-5-2-6-23-40;1-2-18-38(19-3-1)59-51-29-15-12-26-45(51)53-42-23-8-6-20-39(42)47(34-52(53)59)46-33-48-41-22-11-14-28-50(41)60(55(48)43-24-9-7-21-40(43)46)56-57-49-27-13-10-25-44(49)54(58-56)37-31-30-35-16-4-5-17-36(35)32-37/h1-36H;1-34H
InChIKeyFXGFCGJLQKRDDV-UHFFFAOYSA-N
MW1551.87 g/mol
LogP29.75
Rot. Bonds9

About 5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole

5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole (PubChem CID 158169302) has the molecular formula C114H70N8 and a molecular weight of 1551.87 g/mol. Its IUPAC name is 5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole.

Molecular Properties

Compound Name5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole
PubChem CID158169302
Molecular FormulaC114H70N8
Molecular Weight1551.87 g/mol
Exact Mass1550.57
IUPAC Name5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole
SMILESc1ccc(-c2cccc(-c3nc(-n4c5ccccc5c5cc(-c6cc7c(c8ccccc68)c6ccccc6n7-c6ccccc6)c6ccccc6c54)nc4ccccc34)c2)cc1.c1ccc(-n2c3ccccc3c3c4ccccc4c(-c4cc5c6ccccc6n(-c6nc(-c7ccc8ccccc8c7)c7ccccc7n6)c5c5ccccc45)cc32)cc1
InChIInChI=1S/C58H36N4.C56H34N4/c1-3-18-37(19-4-1)38-20-17-21-39(34-38)56-46-29-11-14-31-51(46)59-58(60-56)62-52-32-15-12-26-43(52)50-35-48(42-25-8-10-28-45(42)57(50)62)49-36-54-55(44-27-9-7-24-41(44)49)47-30-13-16-33-53(47)61(54)40-22-5-2-6-23-40;1-2-18-38(19-3-1)59-51-29-15-12-26-45(51)53-42-23-8-6-20-39(42)47(34-52(53)59)46-33-48-41-22-11-14-28-50(41)60(55(48)43-24-9-7-21-40(43)46)56-57-49-27-13-10-25-44(49)54(58-56)37-31-30-35-16-4-5-17-36(35)32-37/h1-36H;1-34H
InChIKeyFXGFCGJLQKRDDV-UHFFFAOYSA-N
XLogP29.75
TPSA71.28 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms122
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001551.87
LogP ≤ 529.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole with MolForge

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Related Compounds

7-phenyl-5-[9-[4-(6-phenylnaphthalen-2-yl)quinazolin-2-yl]carbazol-3-yl]benzo[c]carbazole
CID 118637738
5-phenyl-30-[4-(6-phenylnaphthalen-2-yl)quinazolin-2-yl]-5,30-diazanonacyclo[16.14.1.12,13.04,12.06,11.022,33.023,31.024,29.017,34]tetratriaconta-1(32),2,4(12),6,8,10,13,15,17(34),18(33),19,21,23(31),24,26,28-hexadecaene
CID 118603560
5-[3-(9-phenylcarbazol-3-yl)phenyl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole
CID 134353255
7-[4-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]quinazolin-2-yl]benzo[c]carbazole
CID 71109055
9-(9-naphthalen-2-ylcarbazol-4-yl)-11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazole
CID 155114360
3-[4-(9-phenylcarbazol-3-yl)phenyl]-9-[4-(3-phenylphenyl)quinazolin-2-yl]carbazole
CID 118067227
14-phenyl-9-[4-(3-phenylphenyl)quinazolin-2-yl]-9,14-diazahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene
CID 135165864
5-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]-7-phenylindolo[2,3-b]carbazole
CID 138606242
21-[4-(9-phenylcarbazol-3-yl)quinazolin-2-yl]-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene
CID 89282838
5-(4-naphthalen-2-ylquinazolin-2-yl)-6-(9-phenylcarbazol-3-yl)benzo[b]carbazole
CID 134552532
10-(4-naphthalen-2-ylquinazolin-2-yl)-1,10-diazaoctacyclo[17.10.1.02,18.03,11.04,9.012,17.023,30.024,29]triaconta-2(18),3(11),4,6,8,12,14,16,19,21,23(30),24,26,28-tetradecaene
CID 163570892
5-[4-(2-benzo[c]carbazol-7-ylquinazolin-4-yl)phenyl]-7-phenylbenzo[c]carbazole
CID 71109304

Frequently Asked Questions

What is the IUPAC name of 5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole?
The IUPAC name of 5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole (CID 158169302) is 5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole.
What is the SMILES notation for 5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole?
The canonical SMILES for 5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole is c1ccc(-c2cccc(-c3nc(-n4c5ccccc5c5cc(-c6cc7c(c8ccccc68)c6ccccc6n7-c6ccccc6)c6ccccc6c54)nc4ccccc34)c2)cc1.c1ccc(-n2c3ccccc3c3c4ccccc4c(-c4cc5c6ccccc6n(-c6nc(-c7ccc8ccccc8c7)c7ccccc7n6)c5c5ccccc45)cc32)cc1.
What is the InChIKey of 5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole?
The InChIKey is FXGFCGJLQKRDDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H36N4.C56H34N4/c1-3-18-37(19-4-1)38-20-17-21-39(34-38)56-46-29-11-14-31-51(46)59-58(60-56)62-52-32-15-12-26-43(52)50-35-48(42-25-8-10-28-45(42)57(50)62)49-36-54-55(44-27-9-7-24-41(44)49)47-30-13-16-33-53(47)61(54)40-22-5-2-6-23-40;1-2-18-38(19-3-1)59-51-29-15-12-26-45(51)53-42-23-8-6-20-39(42)47(34-52(53)59)46-33-48-41-22-11-14-28-50(41)60(55(48)43-24-9-7-21-40(43)46)56-57-49-27-13-10-25-44(49)54(58-56)37-31-30-35-16-4-5-17-36(35)32-37/h1-36H;1-34H.
What are the key properties of 5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole?
5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole has a molecular weight of 1551.87 g/mol, XLogP of 29.75, 9 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[11-(4-naphthalen-2-ylquinazolin-2-yl)benzo[a]carbazol-5-yl]-7-phenylbenzo[c]carbazole;5-(7-phenylbenzo[c]carbazol-5-yl)-11-[4-(3-phenylphenyl)quinazolin-2-yl]benzo[a]carbazole is sourced from PubChem (CID 158169302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).