10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole

C60H36N4O — CID 138475136

IUPAC10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole
SMILESc1ccc(-c2nc(-n3c4ccc(-c5ccc6oc7cccc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)c7c6c5)cc4c4c5ccccc5ccc43)nc3ccccc23)cc1
InChIInChI=1S/C60H36N4O/c1-3-15-38(16-4-1)59-46-21-9-11-23-50(46)61-60(62-59)64-53-30-27-39(34-48(53)57-43-19-8-7-14-37(43)26-32-54(57)64)40-29-33-55-49(35-40)58-44(22-13-25-56(58)65-55)41-28-31-52-47(36-41)45-20-10-12-24-51(45)63(52)42-17-5-2-6-18-42/h1-36H
InChIKeyKJJQZPZTOWSWQD-UHFFFAOYSA-N
MW828.98 g/mol
LogP15.88
Rot. Bonds5

About 10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole

10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole (PubChem CID 138475136) has the molecular formula C60H36N4O and a molecular weight of 828.98 g/mol. Its IUPAC name is 10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole.

Molecular Properties

Compound Name10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole
PubChem CID138475136
Molecular FormulaC60H36N4O
Molecular Weight828.98 g/mol
Exact Mass828.29
IUPAC Name10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole
SMILESc1ccc(-c2nc(-n3c4ccc(-c5ccc6oc7cccc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)c7c6c5)cc4c4c5ccccc5ccc43)nc3ccccc23)cc1
InChIInChI=1S/C60H36N4O/c1-3-15-38(16-4-1)59-46-21-9-11-23-50(46)61-60(62-59)64-53-30-27-39(34-48(53)57-43-19-8-7-14-37(43)26-32-54(57)64)40-29-33-55-49(35-40)58-44(22-13-25-56(58)65-55)41-28-31-52-47(36-41)45-20-10-12-24-51(45)63(52)42-17-5-2-6-18-42/h1-36H
InChIKeyKJJQZPZTOWSWQD-UHFFFAOYSA-N
XLogP15.88
TPSA48.78 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms65
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500828.98
LogP ≤ 515.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-[8-(9-phenylcarbazol-3-yl)dibenzofuran-1-yl]-9-[4-(4-phenylphenyl)quinazolin-2-yl]carbazole
CID 138475060
10-[8-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]dibenzofuran-1-yl]-7-phenylbenzo[c]carbazole
CID 138475112
18-[8-(7-phenylbenzo[c]carbazol-10-yl)dibenzofuran-1-yl]-21-(4-phenylquinazolin-2-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene
CID 138475167
7-[4-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]quinazolin-2-yl]benzo[c]carbazole
CID 71109055
7-(4-phenylphenyl)-10-[7-(4-phenylquinazolin-2-yl)benzo[c]carbazol-10-yl]benzo[c]carbazole;7-(4-phenylphenyl)-10-[9-(4-phenylquinazolin-2-yl)carbazol-3-yl]benzo[c]carbazole
CID 165103211
7-[4-(6-dibenzofuran-4-yl-9-phenylcarbazol-3-yl)quinazolin-2-yl]benzo[c]carbazole
CID 123298725
18-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-21-(4-phenylquinazolin-2-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene
CID 138475063
10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)-[1]benzothiolo[2,3-b]carbazole
CID 138475168
3-[9-(4-naphtho[2,1-b][1]benzofuran-5-ylquinazolin-2-yl)carbazol-3-yl]-9-phenylcarbazole;12-(4-naphtho[2,1-b][1]benzofuran-5-ylquinazolin-2-yl)-9,15-diphenyl-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;7-(4-naphtho[2,1-b][1]benzofuran-5-ylquinazolin-2-yl)-10-(9-phenylcarbazol-3-yl)benzo[c]carbazole
CID 158683251
7-(4-naphthalen-2-ylphenyl)-10-[9-(4-phenylquinazolin-2-yl)carbazol-3-yl]benzo[c]carbazole
CID 164784298
10-[9-(4-dibenzofuran-1-ylquinazolin-2-yl)dibenzofuran-2-yl]-7-phenylbenzo[c]carbazole
CID 134594856
8-dibenzofuran-2-yl-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole
CID 142571135

Frequently Asked Questions

What is the IUPAC name of 10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole?
The IUPAC name of 10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole (CID 138475136) is 10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole.
What is the SMILES notation for 10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole?
The canonical SMILES for 10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole is c1ccc(-c2nc(-n3c4ccc(-c5ccc6oc7cccc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)c7c6c5)cc4c4c5ccccc5ccc43)nc3ccccc23)cc1.
What is the InChIKey of 10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole?
The InChIKey is KJJQZPZTOWSWQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H36N4O/c1-3-15-38(16-4-1)59-46-21-9-11-23-50(46)61-60(62-59)64-53-30-27-39(34-48(53)57-43-19-8-7-14-37(43)26-32-54(57)64)40-29-33-55-49(35-40)58-44(22-13-25-56(58)65-55)41-28-31-52-47(36-41)45-20-10-12-24-51(45)63(52)42-17-5-2-6-18-42/h1-36H.
What are the key properties of 10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole?
10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole has a molecular weight of 828.98 g/mol, XLogP of 15.88, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-7-(4-phenylquinazolin-2-yl)benzo[c]carbazole is sourced from PubChem (CID 138475136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).