2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine

C135H85N9O — CID 159954340

IUPAC2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-c3ccc(-c4cc5c6ccccc6oc5c5ccccc45)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccccc43)n2)cc1
InChIInChI=1S/2C46H29N3.C43H27N3O/c1-3-16-30(17-4-1)43-47-44(31-18-5-2-6-19-31)49-45(48-43)36-23-8-7-20-32(36)35-25-15-29-41-42(35)37-24-11-14-28-40(37)46(41)38-26-12-9-21-33(38)34-22-10-13-27-39(34)46;1-3-15-30(16-4-1)43-47-44(31-17-5-2-6-18-31)49-45(48-43)38-23-8-7-19-33(38)32-27-28-37-36-22-11-14-26-41(36)46(42(37)29-32)39-24-12-9-20-34(39)35-21-10-13-25-40(35)46;1-3-13-30(14-4-1)41-44-42(31-15-5-2-6-16-31)46-43(45-41)36-21-10-7-17-32(36)28-23-25-29(26-24-28)37-27-38-34-19-11-12-22-39(34)47-40(38)35-20-9-8-18-33(35)37/h2*1-29H;1-27H
InChIKeyOCNDEJRPVOMXHL-UHFFFAOYSA-N
MW1849.23 g/mol
LogP33.03
Rot. Bonds13

About 2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine

2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine (PubChem CID 159954340) has the molecular formula C135H85N9O and a molecular weight of 1849.23 g/mol. Its IUPAC name is 2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

Compound Name2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine
PubChem CID159954340
Molecular FormulaC135H85N9O
Molecular Weight1849.23 g/mol
Exact Mass1847.69
IUPAC Name2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-c3ccc(-c4cc5c6ccccc6oc5c5ccccc45)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccccc43)n2)cc1
InChIInChI=1S/2C46H29N3.C43H27N3O/c1-3-16-30(17-4-1)43-47-44(31-18-5-2-6-19-31)49-45(48-43)36-23-8-7-20-32(36)35-25-15-29-41-42(35)37-24-11-14-28-40(37)46(41)38-26-12-9-21-33(38)34-22-10-13-27-39(34)46;1-3-15-30(16-4-1)43-47-44(31-17-5-2-6-18-31)49-45(48-43)38-23-8-7-19-33(38)32-27-28-37-36-22-11-14-26-41(36)46(42(37)29-32)39-24-12-9-20-34(39)35-21-10-13-25-40(35)46;1-3-13-30(14-4-1)41-44-42(31-15-5-2-6-16-31)46-43(45-41)36-21-10-7-17-32(36)28-23-25-29(26-24-28)37-27-38-34-19-11-12-22-39(34)47-40(38)35-20-9-8-18-33(35)37/h2*1-29H;1-27H
InChIKeyOCNDEJRPVOMXHL-UHFFFAOYSA-N
XLogP33.03
TPSA129.15 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds13
Heavy Atoms145
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001849.23
LogP ≤ 533.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine with MolForge

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Related Compounds

2-dibenzofuran-4-yl-4-[4-(9,9-diphenylfluoren-2-yl)phenyl]-6-(2-phenylphenyl)-1,3,5-triazine
CID 165160204
2-dibenzofuran-1-yl-4-(4-phenylphenyl)-6-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-11'-yl-1,3,5-triazine;2-dibenzofuran-2-yl-4-(4-phenylphenyl)-6-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-11'-yl-1,3,5-triazine;2-dibenzofuran-4-yl-4-(2-phenylphenyl)-6-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-11'-yl-1,3,5-triazine
CID 158983289
2-dibenzofuran-4-yl-4-(3,5-diphenylphenyl)-6-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-4-yl-1,3,5-triazine
CID 153288093
2-dibenzofuran-2-yl-4-(2-phenylphenyl)-6-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-2-yl-1,3,5-triazine
CID 153288049
2-dibenzofuran-4-yl-4-phenyl-6-(4-spiro[fluorene-9,15'-tetracyclo[10.2.1.05,14.08,13]pentadeca-1,3,5(14),6,8(13),9,11-heptaene]-2-ylphenyl)-1,3,5-triazine
CID 155278995
2-dibenzofuran-4-yl-4-(2-phenylphenyl)-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazine
CID 167349084
2-(2-dibenzofuran-1-ylphenyl)-4-phenyl-6-[3-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-(2-dibenzofuran-2-ylphenyl)-4-phenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-(2-dibenzofuran-2-ylphenyl)-4-phenyl-6-[3-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-(2-dibenzofuran-3-ylphenyl)-4-phenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-(2-dibenzofuran-3-ylphenyl)-4-phenyl-6-[3-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-(2-dibenzofuran-4-ylphenyl)-4-phenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine
CID 162115951
2-dibenzofuran-4-yl-4-(7-naphthalen-1-ylspiro[fluorene-9,9'-xanthene]-4-yl)-6-phenyl-1,3,5-triazine
CID 154597028
2-(4-dibenzofuran-4-ylphenyl)-4-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-2'-ylphenyl)-1,3,5-triazine
CID 140947298
2-[9'-(2,6-diphenylpyrimidin-4-yl)spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-2-yl]-4,6-diphenyl-1,3,5-triazine;2-[3'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,7'-fluoreno[4,3-b][1]benzofuran]-4-yl]-4,6-diphenyl-1,3,5-triazine;2-[3'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[fluorene-9,7'-fluoreno[5,6-b][1]benzofuran]-9'-yl]-4,6-diphenyl-1,3,5-triazine;methane
CID 162212925
2-dibenzofuran-4-yl-4-(4-phenylphenyl)-6-[8-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-1-yl]-1,3,5-triazine
CID 153368965
4-dibenzofuran-4-yl-2-(4-phenylphenyl)-6-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-2-ylpyrimidine
CID 146969373

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine (CID 159954340) is 2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine is c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-c3ccc(-c4cc5c6ccccc6oc5c5ccccc45)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3-c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccccc43)n2)cc1.
What is the InChIKey of 2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine?
The InChIKey is OCNDEJRPVOMXHL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C46H29N3.C43H27N3O/c1-3-16-30(17-4-1)43-47-44(31-18-5-2-6-19-31)49-45(48-43)36-23-8-7-20-32(36)35-25-15-29-41-42(35)37-24-11-14-28-40(37)46(41)38-26-12-9-21-33(38)34-22-10-13-27-39(34)46;1-3-15-30(16-4-1)43-47-44(31-17-5-2-6-18-31)49-45(48-43)38-23-8-7-19-33(38)32-27-28-37-36-22-11-14-26-41(36)46(42(37)29-32)39-24-12-9-20-34(39)35-21-10-13-25-40(35)46;1-3-13-30(14-4-1)41-44-42(31-15-5-2-6-16-31)46-43(45-41)36-21-10-7-17-32(36)28-23-25-29(26-24-28)37-27-38-34-19-11-12-22-39(34)47-40(38)35-20-9-8-18-33(35)37/h2*1-29H;1-27H.
What are the key properties of 2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine?
2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine has a molecular weight of 1849.23 g/mol, XLogP of 33.03, 13 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]-1,3,5-triazine;2,4-diphenyl-6-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine;2-[2-(4-naphtho[1,2-b][1]benzofuran-5-ylphenyl)phenyl]-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 159954340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).