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

C112H68N8 — CID 146539883

IUPAC5-[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
SMILESc1ccc(-c2ccc3c(-n4c5cc(-c6ccccc6)ccc5c5cc6ccccc6cc54)nc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccc6cc7c(cc6c5)c5ccc(-c6ccccc6)cc5n7-c5nc(-c6ccc7c(c6)c6ccccc6n7-c6ccc7ccccc7c6)nc6cc(-c7ccccc7)ccc56)cc4)nc3c2)cc1
InChIInChI=1S/C112H68N8/c1-5-21-69(22-6-1)79-44-53-93-99(63-79)113-109(115-111(93)119-105-66-81(71-25-9-3-10-26-71)42-51-91(105)97-59-76-31-15-16-32-77(76)65-107(97)119)84-46-55-103-95(60-84)89-33-17-19-35-101(89)117(103)87-48-39-74(40-49-87)78-37-38-83-68-108-98(62-86(83)57-78)92-52-43-82(72-27-11-4-12-28-72)67-106(92)120(108)112-94-54-45-80(70-23-7-2-8-24-70)64-100(94)114-110(116-112)85-47-56-104-96(61-85)90-34-18-20-36-102(90)118(104)88-50-41-73-29-13-14-30-75(73)58-88/h1-68H
InChIKeyCIDJAIWOPZKZDO-UHFFFAOYSA-N
MW1525.83 g/mol
LogP29.09
Rot. Bonds11

About 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

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 (PubChem CID 146539883) has the molecular formula C112H68N8 and a molecular weight of 1525.83 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name5-[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
PubChem CID146539883
Molecular FormulaC112H68N8
Molecular Weight1525.83 g/mol
Exact Mass1524.56
IUPAC Name5-[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
SMILESc1ccc(-c2ccc3c(-n4c5cc(-c6ccccc6)ccc5c5cc6ccccc6cc54)nc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccc6cc7c(cc6c5)c5ccc(-c6ccccc6)cc5n7-c5nc(-c6ccc7c(c6)c6ccccc6n7-c6ccc7ccccc7c6)nc6cc(-c7ccccc7)ccc56)cc4)nc3c2)cc1
InChIInChI=1S/C112H68N8/c1-5-21-69(22-6-1)79-44-53-93-99(63-79)113-109(115-111(93)119-105-66-81(71-25-9-3-10-26-71)42-51-91(105)97-59-76-31-15-16-32-77(76)65-107(97)119)84-46-55-103-95(60-84)89-33-17-19-35-101(89)117(103)87-48-39-74(40-49-87)78-37-38-83-68-108-98(62-86(83)57-78)92-52-43-82(72-27-11-4-12-28-72)67-106(92)120(108)112-94-54-45-80(70-23-7-2-8-24-70)64-100(94)114-110(116-112)85-47-56-104-96(61-85)90-34-18-20-36-102(90)118(104)88-50-41-73-29-13-14-30-75(73)58-88/h1-68H
InChIKeyCIDJAIWOPZKZDO-UHFFFAOYSA-N
XLogP29.09
TPSA71.28 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds11
Heavy Atoms120
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001525.83
LogP ≤ 529.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 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 with MolForge

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Related Compounds

3-phenyl-5-[7-phenyl-2-(9-phenylcarbazol-3-yl)quinazolin-4-yl]benzo[b]carbazole
CID 146540884
5-[7-phenyl-2-[9-(4-phenylphenyl)carbazol-2-yl]quinazolin-4-yl]benzo[b]carbazole
CID 139361389
2-benzo[b]carbazol-5-yl-5-(2-naphthalen-2-ylquinazolin-4-yl)benzo[b]carbazole
CID 146375305
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
5-(2,7-dinaphthalen-2-ylquinazolin-4-yl)-2-naphthalen-1-ylbenzo[b]carbazole;5-(2-naphthalen-2-yl-6,7-diphenylquinazolin-4-yl)-2-phenylbenzo[b]carbazole;1-naphthalen-1-yl-5-[2-phenyl-6-(9-phenylcarbazol-2-yl)quinazolin-4-yl]benzo[b]carbazole
CID 157308018
2-phenyl-5-[2-[4-(4-phenylphenyl)phenyl]quinazolin-4-yl]benzo[b]carbazole
CID 146540295
3-[4-(9-naphthalen-2-ylcarbazol-2-yl)phenyl]-9-phenylcarbazole
CID 118919603
3-[9-[3-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-9-phenylcarbazole
CID 130304706
5-[4-[4-naphthalen-2-yl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]phenyl]benzo[b]carbazole
CID 146621318
9-naphthalen-2-yl-2-[4-phenyl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]carbazole
CID 155087222
5-[4-[4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzo[b]carbazole
CID 167032394

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is c1ccc(-c2ccc3c(-n4c5cc(-c6ccccc6)ccc5c5cc6ccccc6cc54)nc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccc6cc7c(cc6c5)c5ccc(-c6ccccc6)cc5n7-c5nc(-c6ccc7c(c6)c6ccccc6n7-c6ccc7ccccc7c6)nc6cc(-c7ccccc7)ccc56)cc4)nc3c2)cc1.
What is the InChIKey of 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?
The InChIKey is CIDJAIWOPZKZDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C112H68N8/c1-5-21-69(22-6-1)79-44-53-93-99(63-79)113-109(115-111(93)119-105-66-81(71-25-9-3-10-26-71)42-51-91(105)97-59-76-31-15-16-32-77(76)65-107(97)119)84-46-55-103-95(60-84)89-33-17-19-35-101(89)117(103)87-48-39-74(40-49-87)78-37-38-83-68-108-98(62-86(83)57-78)92-52-43-82(72-27-11-4-12-28-72)67-106(92)120(108)112-94-54-45-80(70-23-7-2-8-24-70)64-100(94)114-110(116-112)85-47-56-104-96(61-85)90-34-18-20-36-102(90)118(104)88-50-41-73-29-13-14-30-75(73)58-88/h1-68H.
What are the key properties of 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?
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 has a molecular weight of 1525.83 g/mol, XLogP of 29.09, 11 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 146539883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).