3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene

C244H153N9S3 — CID 160933507

IUPAC3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene
SMILES[C-]#[N+]c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c4sc4ccccc45)ccc32)cc1.c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-c2cccc3c2sc2ccccc23)c1.c1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-c4ccc5c6ccccc6c6ccccc6c5c4)c3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc(-c5ccc6c7ccccc7c7ccccc7c6c5)c4)c3)n2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc32)cc1.c1ccc2c(c1)sc1c(-c3ccc4c5ccccc5c5ccccc5c4c3)cccc12
InChIInChI=1S/C48H31N3.C45H29N3.C43H25N3S.C42H28.C36H22S.C30H18S/c1-3-13-34(14-4-1)49-43-20-10-7-17-37(43)40-29-32(23-26-46(40)49)33-24-27-47-41(30-33)38-18-8-12-22-45(38)51(47)36-25-28-48-42(31-36)39-19-9-11-21-44(39)50(48)35-15-5-2-6-16-35;1-3-13-30(14-4-1)43-46-44(31-15-5-2-6-16-31)48-45(47-43)36-20-12-19-34(28-36)32-17-11-18-33(27-32)35-25-26-41-39-23-8-7-21-37(39)38-22-9-10-24-40(38)42(41)29-35;1-44-29-19-21-30(22-20-29)45-37-13-5-2-9-31(37)35-25-27(17-23-39(35)45)28-18-24-40-36(26-28)32-10-3-6-14-38(32)46(40)41-15-8-12-34-33-11-4-7-16-42(33)47-43(34)41;1-3-12-29(13-4-1)34-25-35(30-14-5-2-6-15-30)27-36(26-34)32-17-11-16-31(24-32)33-22-23-41-39-20-8-7-18-37(39)38-19-9-10-21-40(38)42(41)28-33;1-2-13-29-27(11-1)28-12-3-4-14-30(28)34-22-24(19-20-31(29)34)23-9-7-10-25(21-23)26-16-8-17-33-32-15-5-6-18-35(32)37-36(26)33;1-2-10-23-21(8-1)22-9-3-4-11-24(22)28-18-19(16-17-25(23)28)20-13-7-14-27-26-12-5-6-15-29(26)31-30(20)27/h1-31H;1-29H;2-26H;1-28H;1-22H;1-18H
InChIKeySTONTUXYCGCRAN-UHFFFAOYSA-N
MW3307.17 g/mol
LogP68.62
Rot. Bonds19

About 3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene

3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene (PubChem CID 160933507) has the molecular formula C244H153N9S3 and a molecular weight of 3307.17 g/mol. Its IUPAC name is 3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene.

Molecular Properties

Compound Name3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene
PubChem CID160933507
Molecular FormulaC244H153N9S3
Molecular Weight3307.17 g/mol
Exact Mass3304.14
IUPAC Name3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene
SMILES[C-]#[N+]c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c4sc4ccccc45)ccc32)cc1.c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-c2cccc3c2sc2ccccc23)c1.c1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-c4ccc5c6ccccc6c6ccccc6c5c4)c3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc(-c5ccc6c7ccccc7c7ccccc7c6c5)c4)c3)n2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc32)cc1.c1ccc2c(c1)sc1c(-c3ccc4c5ccccc5c5ccccc5c4c3)cccc12
InChIInChI=1S/C48H31N3.C45H29N3.C43H25N3S.C42H28.C36H22S.C30H18S/c1-3-13-34(14-4-1)49-43-20-10-7-17-37(43)40-29-32(23-26-46(40)49)33-24-27-47-41(30-33)38-18-8-12-22-45(38)51(47)36-25-28-48-42(31-36)39-19-9-11-21-44(39)50(48)35-15-5-2-6-16-35;1-3-13-30(14-4-1)43-46-44(31-15-5-2-6-16-31)48-45(47-43)36-20-12-19-34(28-36)32-17-11-18-33(27-32)35-25-26-41-39-23-8-7-21-37(39)38-22-9-10-24-40(38)42(41)29-35;1-44-29-19-21-30(22-20-29)45-37-13-5-2-9-31(37)35-25-27(17-23-39(35)45)28-18-24-40-36(26-28)32-10-3-6-14-38(32)46(40)41-15-8-12-34-33-11-4-7-16-42(33)47-43(34)41;1-3-12-29(13-4-1)34-25-35(30-14-5-2-6-15-30)27-36(26-34)32-17-11-16-31(24-32)33-22-23-41-39-20-8-7-18-37(39)38-19-9-10-21-40(38)42(41)28-33;1-2-13-29-27(11-1)28-12-3-4-14-30(28)34-22-24(19-20-31(29)34)23-9-7-10-25(21-23)26-16-8-17-33-32-15-5-6-18-35(32)37-36(26)33;1-2-10-23-21(8-1)22-9-3-4-11-24(22)28-18-19(16-17-25(23)28)20-13-7-14-27-26-12-5-6-15-29(26)31-30(20)27/h1-31H;1-29H;2-26H;1-28H;1-22H;1-18H
InChIKeySTONTUXYCGCRAN-UHFFFAOYSA-N
XLogP68.62
TPSA67.68 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds19
Heavy Atoms256
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003307.17
LogP ≤ 568.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

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

Analyze 3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene with MolForge

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Related Compounds

3-dibenzothiophen-4-yl-9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole;3-dibenzothiophen-4-yl-9-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole
CID 160959222
3-dibenzothiophen-4-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-dibenzothiophen-4-yl-9-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole;3-dibenzothiophen-4-yl-9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole
CID 158377536
3-dibenzothiophen-4-yl-9-[3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole;3-dibenzothiophen-4-yl-9-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazole
CID 164957895
9-[2-[4-[3-(7-isocyanodibenzothiophen-4-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]-5-phenylphenyl]carbazole
CID 172500455
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-phenylindolo[2,3-b]carbazole;4-(3-triphenylen-2-ylphenyl)dibenzothiophene
CID 160929281
3-carbazol-9-yl-9-[4-(4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-carbazol-9-yl-9-[4-[4-naphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole;3-carbazol-9-yl-9-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-carbazol-9-yl-9-[4-(4-phenyl-6-triphenylen-2-yl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 161474425
9-[2-[4-(3-dibenzothiophen-4-ylphenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-5-phenylphenyl]carbazole
CID 172500254
10-[9-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-12-phenyl-[1]benzothiolo[2,3-a]carbazole;10-[9-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazol-3-yl]-12-phenyl-[1]benzothiolo[2,3-a]carbazole
CID 160750252
3-[4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-4-yl]phenyl]-9-phenylcarbazole
CID 154601885
3,6-di(carbazol-9-yl)-9-[4-dibenzothiophen-4-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 155233234
2-(3-dibenzothiophen-4-ylphenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;4-(3-triphenylen-2-ylphenyl)dibenzothiophene
CID 161177028
9-[5-[4-(4-dibenzothiophen-4-ylphenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-2-phenylphenyl]carbazole
CID 172500359

Frequently Asked Questions

What is the IUPAC name of 3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene?
The IUPAC name of 3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene (CID 160933507) is 3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene.
What is the SMILES notation for 3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene?
The canonical SMILES for 3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene is [C-]#[N+]c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c4sc4ccccc45)ccc32)cc1.c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)cc(-c2cccc3c2sc2ccccc23)c1.c1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-c4ccc5c6ccccc6c6ccccc6c5c4)c3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc(-c5ccc6c7ccccc7c7ccccc7c6c5)c4)c3)n2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc32)cc1.c1ccc2c(c1)sc1c(-c3ccc4c5ccccc5c5ccccc5c4c3)cccc12.
What is the InChIKey of 3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene?
The InChIKey is STONTUXYCGCRAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H31N3.C45H29N3.C43H25N3S.C42H28.C36H22S.C30H18S/c1-3-13-34(14-4-1)49-43-20-10-7-17-37(43)40-29-32(23-26-46(40)49)33-24-27-47-41(30-33)38-18-8-12-22-45(38)51(47)36-25-28-48-42(31-36)39-19-9-11-21-44(39)50(48)35-15-5-2-6-16-35;1-3-13-30(14-4-1)43-46-44(31-15-5-2-6-16-31)48-45(47-43)36-20-12-19-34(28-36)32-17-11-18-33(27-32)35-25-26-41-39-23-8-7-21-37(39)38-22-9-10-24-40(38)42(41)29-35;1-44-29-19-21-30(22-20-29)45-37-13-5-2-9-31(37)35-25-27(17-23-39(35)45)28-18-24-40-36(26-28)32-10-3-6-14-38(32)46(40)41-15-8-12-34-33-11-4-7-16-42(33)47-43(34)41;1-3-12-29(13-4-1)34-25-35(30-14-5-2-6-15-30)27-36(26-34)32-17-11-16-31(24-32)33-22-23-41-39-20-8-7-18-37(39)38-19-9-10-21-40(38)42(41)28-33;1-2-13-29-27(11-1)28-12-3-4-14-30(28)34-22-24(19-20-31(29)34)23-9-7-10-25(21-23)26-16-8-17-33-32-15-5-6-18-35(32)37-36(26)33;1-2-10-23-21(8-1)22-9-3-4-11-24(22)28-18-19(16-17-25(23)28)20-13-7-14-27-26-12-5-6-15-29(26)31-30(20)27/h1-31H;1-29H;2-26H;1-28H;1-22H;1-18H.
What are the key properties of 3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene?
3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene has a molecular weight of 3307.17 g/mol, XLogP of 68.62, 19 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzothiophen-4-ylcarbazol-3-yl)-9-(4-isocyanophenyl)carbazole;2-[3-(3,5-diphenylphenyl)phenyl]triphenylene;2,4-diphenyl-6-[3-(3-triphenylen-2-ylphenyl)phenyl]-1,3,5-triazine;4-triphenylen-2-yldibenzothiophene;4-(3-triphenylen-2-ylphenyl)dibenzothiophene is sourced from PubChem (CID 160933507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).