6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline

C84H50N4O2 — CID 167022858

IUPAC6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline
SMILESc1ccc(-c2nc(-c3ccccc3)c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7nc(-c8ccccc8)c8cc(-c9ccc(-c%10cccc%11oc%12ccccc%12c%10%11)c%10ccccc9%10)ccc8n7)cc6)c6oc7ccccc7c56)c5ccccc45)cc3n2)cc1
InChIInChI=1S/C84H50N4O2/c1-4-19-52(20-5-1)80-69-41-39-57(50-74(69)86-83(87-80)54-23-8-3-9-24-54)59-43-46-66(64-28-13-11-26-62(59)64)68-47-44-60(82-79(68)71-30-15-17-33-76(71)90-82)51-35-37-55(38-36-51)84-85-73-48-40-56(49-72(73)81(88-84)53-21-6-2-7-22-53)58-42-45-65(63-27-12-10-25-61(58)63)67-31-18-34-77-78(67)70-29-14-16-32-75(70)89-77/h1-50H
InChIKeyZHQIVFDPCHPGHL-UHFFFAOYSA-N
MW1147.35 g/mol
LogP22.68
Rot. Bonds9

About 6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline

6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline (PubChem CID 167022858) has the molecular formula C84H50N4O2 and a molecular weight of 1147.35 g/mol. Its IUPAC name is 6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline.

Molecular Properties

Compound Name6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline
PubChem CID167022858
Molecular FormulaC84H50N4O2
Molecular Weight1147.35 g/mol
Exact Mass1146.39
IUPAC Name6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline
SMILESc1ccc(-c2nc(-c3ccccc3)c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7nc(-c8ccccc8)c8cc(-c9ccc(-c%10cccc%11oc%12ccccc%12c%10%11)c%10ccccc9%10)ccc8n7)cc6)c6oc7ccccc7c56)c5ccccc45)cc3n2)cc1
InChIInChI=1S/C84H50N4O2/c1-4-19-52(20-5-1)80-69-41-39-57(50-74(69)86-83(87-80)54-23-8-3-9-24-54)59-43-46-66(64-28-13-11-26-62(59)64)68-47-44-60(82-79(68)71-30-15-17-33-76(71)90-82)51-35-37-55(38-36-51)84-85-73-48-40-56(49-72(73)81(88-84)53-21-6-2-7-22-53)58-42-45-65(63-27-12-10-25-61(58)63)67-31-18-34-77-78(67)70-29-14-16-32-75(70)89-77/h1-50H
InChIKeyZHQIVFDPCHPGHL-UHFFFAOYSA-N
XLogP22.68
TPSA77.84 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms90
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001147.35
LogP ≤ 522.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline with MolForge

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Related Compounds

7-(4-dibenzofuran-1-ylphenyl)-2,4-diphenylquinazoline
CID 146353553
6-(4-dibenzofuran-1-ylphenyl)-2,4-diphenylquinazoline;7-(4-dibenzofuran-1-ylphenyl)-2,4-diphenylquinazoline;5-(4-dibenzofuran-1-ylphenyl)-2,3-diphenylquinoxaline
CID 165054552
2-dibenzofuran-3-yl-4-[4-(1-dibenzofuran-1-yldibenzofuran-4-yl)phenyl]-6-phenyl-1,3,5-triazine
CID 155603269
2,4-diphenyl-6-[3-(4-phenyldibenzofuran-1-yl)phenyl]-1,3,5-triazine
CID 130289437
2-dibenzofuran-3-yl-4-[4-(1-dibenzofuran-4-yldibenzofuran-4-yl)phenyl]-6-phenyl-1,3,5-triazine
CID 155078432
2-[6-dibenzofuran-2-yl-4-(4-phenylphenyl)dibenzofuran-1-yl]-4-phenylquinazoline
CID 156575030
2-dibenzofuran-4-yl-4-[4-(1-dibenzofuran-2-yldibenzofuran-4-yl)phenyl]-6-phenyl-1,3,5-triazine
CID 155077824
2-dibenzofuran-4-yl-4-(4-dibenzofuran-3-yldibenzofuran-1-yl)-6-phenyl-1,3,5-triazine
CID 155077731
4-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-phenyl-6-(5-phenylnaphthalen-1-yl)pyrimidine
CID 176632187
2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-1-ylphenyl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylphenyl)-4,6-diphenyl-1,3,5-triazine
CID 165090138
2-phenyl-4-[9-(4-phenylnaphthalen-1-yl)dibenzofuran-2-yl]-6-(3-phenylphenyl)-1,3,5-triazine
CID 135233850
2-dibenzofuran-3-yl-4-[4-(4-dibenzofuran-3-yldibenzofuran-1-yl)phenyl]-6-(3-phenylphenyl)-1,3,5-triazine
CID 155077748

Frequently Asked Questions

What is the IUPAC name of 6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline?
The IUPAC name of 6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline (CID 167022858) is 6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline.
What is the SMILES notation for 6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline?
The canonical SMILES for 6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline is c1ccc(-c2nc(-c3ccccc3)c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7nc(-c8ccccc8)c8cc(-c9ccc(-c%10cccc%11oc%12ccccc%12c%10%11)c%10ccccc9%10)ccc8n7)cc6)c6oc7ccccc7c56)c5ccccc45)cc3n2)cc1.
What is the InChIKey of 6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline?
The InChIKey is ZHQIVFDPCHPGHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H50N4O2/c1-4-19-52(20-5-1)80-69-41-39-57(50-74(69)86-83(87-80)54-23-8-3-9-24-54)59-43-46-66(64-28-13-11-26-62(59)64)68-47-44-60(82-79(68)71-30-15-17-33-76(71)90-82)51-35-37-55(38-36-51)84-85-73-48-40-56(49-72(73)81(88-84)53-21-6-2-7-22-53)58-42-45-65(63-27-12-10-25-61(58)63)67-31-18-34-77-78(67)70-29-14-16-32-75(70)89-77/h1-50H.
What are the key properties of 6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline?
6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline has a molecular weight of 1147.35 g/mol, XLogP of 22.68, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-dibenzofuran-1-ylnaphthalen-1-yl)-2-[4-[1-[4-(2,4-diphenylquinazolin-7-yl)naphthalen-1-yl]dibenzofuran-4-yl]phenyl]-4-phenylquinazoline is sourced from PubChem (CID 167022858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).