1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole

C159H98N12O2S — CID 165030256

IUPAC1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole
SMILESc1ccc(-c2cc(-c3ccc4c(c3)sc3c5ccccc5ccc43)cc(-c3nc(-c4cccc5ccccc45)nc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)n3)c2)cc1.c1ccc(-c2ccccc2-c2nc(-c3cc(-c4ccc5oc6ccccc6c5c4)c4ccccc4c3)nc(-c3cccc4c5ccccc5n(-c5ccccc5)c34)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4cccc5c4oc4ccccc45)c3)nc(-c3cccc4c5ccccc5n(-c5ccccc5)c34)n2)cc1
InChIInChI=1S/C59H36N4S.C55H34N4O.C45H28N4O/c1-3-15-37(16-4-1)41-33-42(40-30-31-48-50-32-29-39-18-8-10-23-46(39)56(50)64-54(48)36-40)35-43(34-41)57-60-58(51-26-13-19-38-17-7-9-22-45(38)51)62-59(61-57)52-27-14-25-49-47-24-11-12-28-53(47)63(55(49)52)44-20-5-2-6-21-44;1-3-16-35(17-4-1)40-21-9-10-25-45(40)54-56-53(57-55(58-54)46-27-15-26-44-42-23-11-13-28-49(42)59(52(44)46)39-19-5-2-6-20-39)38-32-36-18-7-8-22-41(36)47(34-38)37-30-31-51-48(33-37)43-24-12-14-29-50(43)60-51;1-3-14-29(15-4-1)43-46-44(31-17-11-16-30(28-31)33-22-12-24-37-35-21-8-10-27-40(35)50-42(33)37)48-45(47-43)38-25-13-23-36-34-20-7-9-26-39(34)49(41(36)38)32-18-5-2-6-19-32/h1-36H;1-34H;1-28H
InChIKeyMNQJSLHHZORKPK-UHFFFAOYSA-N
MW2240.68 g/mol
LogP41.87
Rot. Bonds17

About 1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole

1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole (PubChem CID 165030256) has the molecular formula C159H98N12O2S and a molecular weight of 2240.68 g/mol. Its IUPAC name is 1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole
PubChem CID165030256
Molecular FormulaC159H98N12O2S
Molecular Weight2240.68 g/mol
Exact Mass2238.77
IUPAC Name1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole
SMILESc1ccc(-c2cc(-c3ccc4c(c3)sc3c5ccccc5ccc43)cc(-c3nc(-c4cccc5ccccc45)nc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)n3)c2)cc1.c1ccc(-c2ccccc2-c2nc(-c3cc(-c4ccc5oc6ccccc6c5c4)c4ccccc4c3)nc(-c3cccc4c5ccccc5n(-c5ccccc5)c34)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4cccc5c4oc4ccccc45)c3)nc(-c3cccc4c5ccccc5n(-c5ccccc5)c34)n2)cc1
InChIInChI=1S/C59H36N4S.C55H34N4O.C45H28N4O/c1-3-15-37(16-4-1)41-33-42(40-30-31-48-50-32-29-39-18-8-10-23-46(39)56(50)64-54(48)36-40)35-43(34-41)57-60-58(51-26-13-19-38-17-7-9-22-45(38)51)62-59(61-57)52-27-14-25-49-47-24-11-12-28-53(47)63(55(49)52)44-20-5-2-6-21-44;1-3-16-35(17-4-1)40-21-9-10-25-45(40)54-56-53(57-55(58-54)46-27-15-26-44-42-23-11-13-28-49(42)59(52(44)46)39-19-5-2-6-20-39)38-32-36-18-7-8-22-41(36)47(34-38)37-30-31-51-48(33-37)43-24-12-14-29-50(43)60-51;1-3-14-29(15-4-1)43-46-44(31-17-11-16-30(28-31)33-22-12-24-37-35-21-8-10-27-40(35)50-42(33)37)48-45(47-43)38-25-13-23-36-34-20-7-9-26-39(34)49(41(36)38)32-18-5-2-6-19-32/h1-36H;1-34H;1-28H
InChIKeyMNQJSLHHZORKPK-UHFFFAOYSA-N
XLogP41.87
TPSA157.08 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds17
Heavy Atoms174
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002240.68
LogP ≤ 541.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole with MolForge

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Related Compounds

12-[3-[4-[4-(3-dibenzofuran-4-ylphenyl)phenyl]-6-[3-(2-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]-11-phenylindolo[2,3-a]carbazole;12-[3-[4-[4-(3-dibenzothiophen-4-ylphenyl)phenyl]-6-(3-naphthalen-1-ylphenyl)-1,3,5-triazin-2-yl]phenyl]-11-phenylindolo[2,3-a]carbazole;2-(8-naphthalen-1-yldibenzofuran-4-yl)-4-(3-naphthalen-1-ylphenyl)-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-(8-phenanthren-9-yldibenzothiophen-4-yl)-4-(3-phenanthren-9-ylphenyl)-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 162155540
1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 164736807
1-[8-[4-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]dibenzofuran-3-yl]-9-phenylcarbazole
CID 157480548
9-phenyl-1-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole
CID 162699405
3-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-9-phenylcarbazole;4-[4-(3-dibenzothiophen-3-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;4-[4-(3-dibenzothiophen-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 161402392
1-[6-(4-dibenzofuran-4-yl-6-phenanthren-2-yl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-9-phenylcarbazole
CID 139342497
2-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-1-yl]-9-phenylcarbazole;2-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-9-phenylcarbazole;2-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-3-yl]-9-phenylcarbazole;2-[7-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]-9-phenylcarbazole
CID 159094409
2-(6-dibenzofuran-4-yldibenzofuran-4-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(6-dibenzothiophen-4-yldibenzofuran-4-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(6,8-diphenyldibenzofuran-4-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[6-(4-phenylphenyl)dibenzofuran-2-yl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[8-(4-phenylphenyl)dibenzofuran-2-yl]-1,3,5-triazine;9-[6-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]carbazole
CID 163425573
2-dibenzofuran-4-yl-9-[2-phenyl-4-[4-phenyl-6-[3-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole;2-dibenzothiophen-4-yl-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenylphenyl]carbazole
CID 165073222
2-[4-[4-dibenzofuran-4-yl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-9-phenylcarbazole
CID 165160169
1-[7-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-6,9-diphenylcarbazole;1-[8-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-6,9-diphenylcarbazole;2-[7-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-6,9-diphenylcarbazole
CID 157292587
3-[8-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenylcarbazole
CID 158230973

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole?
The IUPAC name of 1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole (CID 165030256) is 1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole.
What is the SMILES notation for 1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole?
The canonical SMILES for 1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole is c1ccc(-c2cc(-c3ccc4c(c3)sc3c5ccccc5ccc43)cc(-c3nc(-c4cccc5ccccc45)nc(-c4cccc5c6ccccc6n(-c6ccccc6)c45)n3)c2)cc1.c1ccc(-c2ccccc2-c2nc(-c3cc(-c4ccc5oc6ccccc6c5c4)c4ccccc4c3)nc(-c3cccc4c5ccccc5n(-c5ccccc5)c34)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4cccc5c4oc4ccccc45)c3)nc(-c3cccc4c5ccccc5n(-c5ccccc5)c34)n2)cc1.
What is the InChIKey of 1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole?
The InChIKey is MNQJSLHHZORKPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H36N4S.C55H34N4O.C45H28N4O/c1-3-15-37(16-4-1)41-33-42(40-30-31-48-50-32-29-39-18-8-10-23-46(39)56(50)64-54(48)36-40)35-43(34-41)57-60-58(51-26-13-19-38-17-7-9-22-45(38)51)62-59(61-57)52-27-14-25-49-47-24-11-12-28-53(47)63(55(49)52)44-20-5-2-6-21-44;1-3-16-35(17-4-1)40-21-9-10-25-45(40)54-56-53(57-55(58-54)46-27-15-26-44-42-23-11-13-28-49(42)59(52(44)46)39-19-5-2-6-20-39)38-32-36-18-7-8-22-41(36)47(34-38)37-30-31-51-48(33-37)43-24-12-14-29-50(43)60-51;1-3-14-29(15-4-1)43-46-44(31-17-11-16-30(28-31)33-22-12-24-37-35-21-8-10-27-40(35)50-42(33)37)48-45(47-43)38-25-13-23-36-34-20-7-9-26-39(34)49(41(36)38)32-18-5-2-6-19-32/h1-36H;1-34H;1-28H.
What are the key properties of 1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole?
1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole has a molecular weight of 2240.68 g/mol, XLogP of 41.87, 17 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-dibenzofuran-2-ylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-(3-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;1-[4-naphthalen-1-yl-6-(3-naphtho[1,2-b][1]benzothiol-9-yl-5-phenylphenyl)-1,3,5-triazin-2-yl]-9-phenylcarbazole is sourced from PubChem (CID 165030256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).