9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole

C153H90N12O3S3 — CID 163976267

IUPAC9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole
SMILES[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc4c(c3)oc3ccccc34)nc(-c3cc(-n4c5ccccc5c5ccccc54)cc4c3sc3ccc(-c5ccccc5)cc34)n2)c([2H])c1[2H].c1ccc(-c2ccc3sc4c(-c5nc(-c6ccccc6)nc(-c6cccc7c6oc6ccccc67)n5)cc(-n5c6ccccc6c6ccccc65)cc4c3c2)cc1.c1ccc(-c2ccc3sc4c(-c5nc(-c6ccccc6)nc(-c6cccc7oc8ccccc8c67)n5)cc(-n5c6ccccc6c6ccccc65)cc4c3c2)cc1
InChIInChI=1S/3C51H30N4OS/c1-3-14-31(15-4-1)33-26-27-46-40(28-33)41-29-34(55-43-23-10-7-18-35(43)36-19-8-11-24-44(36)55)30-42(48(41)57-46)51-53-49(32-16-5-2-6-17-32)52-50(54-51)39-22-13-21-38-37-20-9-12-25-45(37)56-47(38)39;1-3-14-31(15-4-1)33-26-27-46-39(28-33)40-29-34(55-42-22-10-7-18-35(42)36-19-8-11-23-43(36)55)30-41(48(40)57-46)51-53-49(32-16-5-2-6-17-32)52-50(54-51)38-21-13-25-45-47(38)37-20-9-12-24-44(37)56-45;1-3-13-31(14-4-1)33-24-26-47-40(27-33)41-29-35(55-43-20-10-7-17-36(43)37-18-8-11-21-44(37)55)30-42(48(41)57-47)51-53-49(32-15-5-2-6-16-32)52-50(54-51)34-23-25-39-38-19-9-12-22-45(38)56-46(39)28-34/h3*1-30H/i;;2D,5D,6D,15D,16D
InChIKeySUKVSSIWSLTLDE-HQPJVCOPSA-N
MW2245.72 g/mol
LogP41.71
Rot. Bonds15

About 9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole

9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole (PubChem CID 163976267) has the molecular formula C153H90N12O3S3 and a molecular weight of 2245.72 g/mol. Its IUPAC name is 9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole.

Molecular Properties

Compound Name9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole
PubChem CID163976267
Molecular FormulaC153H90N12O3S3
Molecular Weight2245.72 g/mol
Exact Mass2243.67
IUPAC Name9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole
SMILES[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc4c(c3)oc3ccccc34)nc(-c3cc(-n4c5ccccc5c5ccccc54)cc4c3sc3ccc(-c5ccccc5)cc34)n2)c([2H])c1[2H].c1ccc(-c2ccc3sc4c(-c5nc(-c6ccccc6)nc(-c6cccc7c6oc6ccccc67)n5)cc(-n5c6ccccc6c6ccccc65)cc4c3c2)cc1.c1ccc(-c2ccc3sc4c(-c5nc(-c6ccccc6)nc(-c6cccc7oc8ccccc8c67)n5)cc(-n5c6ccccc6c6ccccc65)cc4c3c2)cc1
InChIInChI=1S/3C51H30N4OS/c1-3-14-31(15-4-1)33-26-27-46-40(28-33)41-29-34(55-43-23-10-7-18-35(43)36-19-8-11-24-44(36)55)30-42(48(41)57-46)51-53-49(32-16-5-2-6-17-32)52-50(54-51)39-22-13-21-38-37-20-9-12-25-45(37)56-47(38)39;1-3-14-31(15-4-1)33-26-27-46-39(28-33)40-29-34(55-42-22-10-7-18-35(42)36-19-8-11-23-43(36)55)30-41(48(40)57-46)51-53-49(32-16-5-2-6-17-32)52-50(54-51)38-21-13-25-45-47(38)37-20-9-12-24-44(37)56-45;1-3-13-31(14-4-1)33-24-26-47-40(27-33)41-29-35(55-43-20-10-7-17-36(43)37-18-8-11-21-44(37)55)30-42(48(41)57-47)51-53-49(32-15-5-2-6-16-32)52-50(54-51)34-23-25-39-38-19-9-12-22-45(38)56-46(39)28-34/h3*1-30H/i;;2D,5D,6D,15D,16D
InChIKeySUKVSSIWSLTLDE-HQPJVCOPSA-N
XLogP41.71
TPSA170.22 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds15
Heavy Atoms171
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002245.72
LogP ≤ 541.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole with MolForge

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Related Compounds

9-[8-[4-dibenzofuran-1-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole;9-[8-[4-dibenzofuran-2-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole;9-[8-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]dibenzothiophen-3-yl]carbazole;9-[8-[4-dibenzofuran-4-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]dibenzothiophen-3-yl]carbazole
CID 159406108
9-[4-[4-(3-dibenzofuran-4-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzothiophen-2-yl]carbazole
CID 162780486
9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-8-(4-phenylphenyl)dibenzothiophen-2-yl]carbazole
CID 162780319
9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenanthren-9-yl-1,3,5-triazin-2-yl]-9-(4-phenylphenyl)dibenzothiophen-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-7-(3-phenylphenyl)dibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]-7-(3-phenylphenyl)dibenzofuran-2-yl]carbazole
CID 163857430
9-[4-(2-carbazol-9-yl-8-phenyldibenzothiophen-4-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-2-phenylcarbazole
CID 162780614
9-[9-[4-dibenzofuran-1-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-3-phenylcarbazole;9-[9-[4-dibenzofuran-2-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-3-phenylcarbazole;9-[9-[4-dibenzofuran-4-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-2-phenylcarbazole
CID 159038565
9-[8-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole;9-[8-[4-dibenzofuran-4-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole;9-[8-[4-dibenzothiophen-1-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]carbazole
CID 158185125
9-[6-[4-dibenzofuran-1-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]carbazole
CID 160655228
9-[7-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-4-phenyldibenzofuran-2-yl]carbazole
CID 166495859
9-[9-phenyl-4-[4-phenyl-6-(2,3,5,6-tetradeuterio-4-dibenzofuran-4-ylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]carbazole
CID 162780535
9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole
CID 162780378
3-[9-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-9-phenylcarbazole
CID 168770380

Frequently Asked Questions

What is the IUPAC name of 9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole?
The IUPAC name of 9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole (CID 163976267) is 9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole.
What is the SMILES notation for 9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole?
The canonical SMILES for 9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole is [2H]c1c([2H])c([2H])c(-c2nc(-c3ccc4c(c3)oc3ccccc34)nc(-c3cc(-n4c5ccccc5c5ccccc54)cc4c3sc3ccc(-c5ccccc5)cc34)n2)c([2H])c1[2H].c1ccc(-c2ccc3sc4c(-c5nc(-c6ccccc6)nc(-c6cccc7c6oc6ccccc67)n5)cc(-n5c6ccccc6c6ccccc65)cc4c3c2)cc1.c1ccc(-c2ccc3sc4c(-c5nc(-c6ccccc6)nc(-c6cccc7oc8ccccc8c67)n5)cc(-n5c6ccccc6c6ccccc65)cc4c3c2)cc1.
What is the InChIKey of 9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole?
The InChIKey is SUKVSSIWSLTLDE-HQPJVCOPSA-N. The full InChI is InChI=1S/3C51H30N4OS/c1-3-14-31(15-4-1)33-26-27-46-40(28-33)41-29-34(55-43-23-10-7-18-35(43)36-19-8-11-24-44(36)55)30-42(48(41)57-46)51-53-49(32-16-5-2-6-17-32)52-50(54-51)39-22-13-21-38-37-20-9-12-25-45(37)56-47(38)39;1-3-14-31(15-4-1)33-26-27-46-39(28-33)40-29-34(55-42-22-10-7-18-35(42)36-19-8-11-23-43(36)55)30-41(48(40)57-46)51-53-49(32-16-5-2-6-17-32)52-50(54-51)38-21-13-25-45-47(38)37-20-9-12-24-44(37)56-45;1-3-13-31(14-4-1)33-24-26-47-40(27-33)41-29-35(55-43-20-10-7-17-36(43)37-18-8-11-21-44(37)55)30-42(48(41)57-47)51-53-49(32-15-5-2-6-16-32)52-50(54-51)34-23-25-39-38-19-9-12-22-45(38)56-46(39)28-34/h3*1-30H/i;;2D,5D,6D,15D,16D.
What are the key properties of 9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole?
9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole has a molecular weight of 2245.72 g/mol, XLogP of 41.71, 15 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[4-dibenzofuran-3-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole;9-[4-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-8-phenyldibenzothiophen-2-yl]carbazole is sourced from PubChem (CID 163976267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).