2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine

C153H97N9O3 — CID 165016685

IUPAC2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc5c(c4)oc4cc(-c6ccccc6)cc(-c6ccccc6)c45)nc(-c4cc5ccccc5c5ccccc45)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc5c(c4)oc4cc(-c6ccccc6)cc(-c6ccccc6)c45)nc(-c4cccc5ccccc45)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4ccc5c(c4)oc4cc(-c6ccccc6)cc(-c6ccccc6)c45)n3)cc2)cc1
InChIInChI=1S/C53H33N3O.C51H33N3O.C49H31N3O/c1-4-14-34(15-5-1)36-24-26-38(27-25-36)51-54-52(56-53(55-51)47-30-39-20-10-11-21-42(39)43-22-12-13-23-44(43)47)40-28-29-45-48(32-40)57-49-33-41(35-16-6-2-7-17-35)31-46(50(45)49)37-18-8-3-9-19-37;1-5-14-34(15-6-1)37-24-26-39(27-25-37)49-52-50(41-23-13-22-40(30-41)35-16-7-2-8-17-35)54-51(53-49)42-28-29-44-46(32-42)55-47-33-43(36-18-9-3-10-19-36)31-45(48(44)47)38-20-11-4-12-21-38;1-4-13-32(14-5-1)34-23-25-37(26-24-34)47-50-48(52-49(51-47)41-22-12-20-35-19-10-11-21-40(35)41)38-27-28-42-44(30-38)53-45-31-39(33-15-6-2-7-16-33)29-43(46(42)45)36-17-8-3-9-18-36/h1-33H;1-33H;1-31H
InChIKeyKNKNKXNXTQKZAX-UHFFFAOYSA-N
MW2109.52 g/mol
LogP40.45
Rot. Bonds19

About 2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine

2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine (PubChem CID 165016685) has the molecular formula C153H97N9O3 and a molecular weight of 2109.52 g/mol. Its IUPAC name is 2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
PubChem CID165016685
Molecular FormulaC153H97N9O3
Molecular Weight2109.52 g/mol
Exact Mass2107.77
IUPAC Name2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2ccc(-c3nc(-c4ccc5c(c4)oc4cc(-c6ccccc6)cc(-c6ccccc6)c45)nc(-c4cc5ccccc5c5ccccc45)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc5c(c4)oc4cc(-c6ccccc6)cc(-c6ccccc6)c45)nc(-c4cccc5ccccc45)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4ccc5c(c4)oc4cc(-c6ccccc6)cc(-c6ccccc6)c45)n3)cc2)cc1
InChIInChI=1S/C53H33N3O.C51H33N3O.C49H31N3O/c1-4-14-34(15-5-1)36-24-26-38(27-25-36)51-54-52(56-53(55-51)47-30-39-20-10-11-21-42(39)43-22-12-13-23-44(43)47)40-28-29-45-48(32-40)57-49-33-41(35-16-6-2-7-17-35)31-46(50(45)49)37-18-8-3-9-19-37;1-5-14-34(15-6-1)37-24-26-39(27-25-37)49-52-50(41-23-13-22-40(30-41)35-16-7-2-8-17-35)54-51(53-49)42-28-29-44-46(32-42)55-47-33-43(36-18-9-3-10-19-36)31-45(48(44)47)38-20-11-4-12-21-38;1-4-13-32(14-5-1)34-23-25-37(26-24-34)47-50-48(52-49(51-47)41-22-12-20-35-19-10-11-21-40(35)41)38-27-28-42-44(30-38)53-45-31-39(33-15-6-2-7-16-33)29-43(46(42)45)36-17-8-3-9-18-36/h1-33H;1-33H;1-31H
InChIKeyKNKNKXNXTQKZAX-UHFFFAOYSA-N
XLogP40.45
TPSA155.43 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds19
Heavy Atoms165
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002109.52
LogP ≤ 540.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze 2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine with MolForge

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Related Compounds

2-[9-(3,5-diphenylphenyl)dibenzofuran-3-yl]-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-[9-(3,5-diphenylphenyl)dibenzofuran-3-yl]-4-phenanthren-9-yl-6-phenyl-1,3,5-triazine;2-[9-(3,5-diphenylphenyl)dibenzofuran-3-yl]-4-phenyl-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-[9-(3,5-diphenylphenyl)dibenzofuran-3-yl]-4-phenyl-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 165091111
2-phenanthren-9-yl-4-(3-phenylphenyl)-6-[9-(3-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine
CID 164798054
2-(9-phenyldibenzofuran-3-yl)-4-(6-phenylnaphthalen-1-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 164797611
2,4-diphenyl-6-[1-(2-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine;3-(3,5-diphenylphenyl)-1-(2-triphenylen-2-ylphenyl)dibenzofuran;2,4-diphenyl-6-(1-triphenylen-2-yldibenzofuran-3-yl)-1,3,5-triazine;2-[1-(2-naphthalen-1-ylphenyl)dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine;2-(1-phenanthren-9-yldibenzofuran-3-yl)-4,6-diphenyl-1,3,5-triazine;2-[1-(2-phenanthren-9-ylphenyl)dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine
CID 162192558
2-phenanthren-2-yl-4-phenyl-6-[9-[3-(4-phenylphenyl)phenyl]dibenzofuran-3-yl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-[9-[3-(4-phenylphenyl)phenyl]dibenzofuran-3-yl]-1,3,5-triazine;2-phenyl-4-(7-phenylnaphthalen-2-yl)-6-[9-[3-(4-phenylphenyl)phenyl]dibenzofuran-3-yl]-1,3,5-triazine;2-phenyl-4-(8-phenylnaphthalen-2-yl)-6-[9-[3-(4-phenylphenyl)phenyl]dibenzofuran-3-yl]-1,3,5-triazine
CID 165003214
2-chrysen-3-yl-4-[7-(3-phenylphenyl)dibenzofuran-1-yl]-6-[4-[6-[4-phenyl-6-[7-(4-phenylphenyl)dibenzofuran-1-yl]-1,3,5-triazin-2-yl]chrysen-1-yl]phenyl]-1,3,5-triazine
CID 170016012
2-naphthalen-1-yl-4-phenyl-6-[7-(4-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine
CID 171597325
2-naphthalen-1-yl-4-[9-(4-naphthalen-2-ylphenyl)dibenzofuran-3-yl]-6-phenyl-1,3,5-triazine
CID 164798033
2-chrysen-2-yl-4-(1-phenyldibenzofuran-3-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 174259613
2-phenanthren-2-yl-4-phenyl-6-[9-(3-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine
CID 164797435
2-phenanthren-2-yl-4-(4-phenylphenyl)-6-[9-(3-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine;2-(4-phenylphenyl)-4-[9-(3-phenylphenyl)dibenzofuran-3-yl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-(4-phenylphenyl)-4-[9-(3-phenylphenyl)dibenzofuran-3-yl]-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-(4-phenylphenyl)-4-[9-(3-phenylphenyl)dibenzofuran-3-yl]-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 165084892
2-(7-phenanthren-2-yldibenzofuran-1-yl)-4,6-diphenyl-1,3,5-triazine
CID 166741783

Frequently Asked Questions

What is the IUPAC name of 2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine?
The IUPAC name of 2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine (CID 165016685) is 2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine?
The canonical SMILES for 2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine is c1ccc(-c2ccc(-c3nc(-c4ccc5c(c4)oc4cc(-c6ccccc6)cc(-c6ccccc6)c45)nc(-c4cc5ccccc5c5ccccc45)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc5c(c4)oc4cc(-c6ccccc6)cc(-c6ccccc6)c45)nc(-c4cccc5ccccc45)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4ccc5c(c4)oc4cc(-c6ccccc6)cc(-c6ccccc6)c45)n3)cc2)cc1.
What is the InChIKey of 2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine?
The InChIKey is KNKNKXNXTQKZAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H33N3O.C51H33N3O.C49H31N3O/c1-4-14-34(15-5-1)36-24-26-38(27-25-36)51-54-52(56-53(55-51)47-30-39-20-10-11-21-42(39)43-22-12-13-23-44(43)47)40-28-29-45-48(32-40)57-49-33-41(35-16-6-2-7-17-35)31-46(50(45)49)37-18-8-3-9-19-37;1-5-14-34(15-6-1)37-24-26-39(27-25-37)49-52-50(41-23-13-22-40(30-41)35-16-7-2-8-17-35)54-51(53-49)42-28-29-44-46(32-42)55-47-33-43(36-18-9-3-10-19-36)31-45(48(44)47)38-20-11-4-12-21-38;1-4-13-32(14-5-1)34-23-25-37(26-24-34)47-50-48(52-49(51-47)41-22-12-20-35-19-10-11-21-40(35)41)38-27-28-42-44(30-38)53-45-31-39(33-15-6-2-7-16-33)29-43(46(42)45)36-17-8-3-9-18-36/h1-33H;1-33H;1-31H.
What are the key properties of 2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine?
2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine has a molecular weight of 2109.52 g/mol, XLogP of 40.45, 19 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7,9-diphenyldibenzofuran-3-yl)-4-naphthalen-1-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-phenanthren-9-yl-6-(4-phenylphenyl)-1,3,5-triazine;2-(7,9-diphenyldibenzofuran-3-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine is sourced from PubChem (CID 165016685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).