9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole

C273H170N20 — CID 160507007

IUPAC9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc3c4ccccc4c4c(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cccc4c3c2)cc1.c1ccc(-c2ccc3c4ccc(-c5ccccc5)cc4n(-c4cccc5c6ccccc6c6cccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)c6c45)c3c2)cc1.c1ccc(-c2ccc3c4ccccc4n(-c4ccc5c6ccccc6c6cc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)ccc6c5c4)c3c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)c3ccccc3c3ccc(-n5c6ccccc6c6cc(-c7ccc8c9ccccc9c9ccccc9c8c7)ccc65)cc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c5cc(-n6c7ccccc7c7ccccc76)ccc5c5ccccc5c34)n2)cc1
InChIInChI=1S/C63H38N4.2C57H36N4.C51H32N4.C45H28N4/c1-3-15-39(16-4-1)61-64-62(40-17-5-2-6-18-40)66-63(65-61)43-28-32-53-56(37-43)50-24-12-10-22-48(50)52-33-30-44(38-57(52)53)67-59-26-14-13-25-54(59)58-36-42(29-34-60(58)67)41-27-31-51-47-21-8-7-19-45(47)46-20-9-11-23-49(46)55(51)35-41;1-5-17-37(18-6-1)41-31-33-45-46-34-32-42(38-19-7-2-8-20-38)36-52(46)61(51(45)35-41)50-30-16-28-48-44-26-14-13-25-43(44)47-27-15-29-49(53(47)54(48)50)57-59-55(39-21-9-3-10-22-39)58-56(60-57)40-23-11-4-12-24-40;1-5-16-37(17-6-1)41-28-32-52-50(34-41)51-35-42(38-18-7-2-8-19-38)29-33-53(51)61(52)43-30-31-45-44-24-13-14-25-46(44)54-47(49(45)36-43)26-15-27-48(54)57-59-55(39-20-9-3-10-21-39)58-56(60-57)40-22-11-4-12-23-40;1-4-14-33(15-5-1)36-24-28-44-43-22-12-13-23-47(43)55(48(44)31-36)38-26-29-41-39-20-10-11-21-40(39)45-30-37(25-27-42(45)46(41)32-38)51-53-49(34-16-6-2-7-17-34)52-50(54-51)35-18-8-3-9-19-35;1-3-14-29(15-4-1)43-46-44(30-16-5-2-6-17-30)48-45(47-43)38-23-13-22-37-39-28-31(26-27-33(39)32-18-7-8-21-36(32)42(37)38)49-40-24-11-9-19-34(40)35-20-10-12-25-41(35)49/h1-38H;2*1-36H;1-32H;1-28H
InChIKeyQSNUXBSSFMUCBH-UHFFFAOYSA-N
MW3730.50 g/mol
LogP70.61
Rot. Bonds26

About 9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole

9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole (PubChem CID 160507007) has the molecular formula C273H170N20 and a molecular weight of 3730.50 g/mol. Its IUPAC name is 9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole.

Molecular Properties

Compound Name9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole
PubChem CID160507007
Molecular FormulaC273H170N20
Molecular Weight3730.50 g/mol
Exact Mass3727.39
IUPAC Name9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc3c4ccccc4c4c(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cccc4c3c2)cc1.c1ccc(-c2ccc3c4ccc(-c5ccccc5)cc4n(-c4cccc5c6ccccc6c6cccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)c6c45)c3c2)cc1.c1ccc(-c2ccc3c4ccccc4n(-c4ccc5c6ccccc6c6cc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)ccc6c5c4)c3c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)c3ccccc3c3ccc(-n5c6ccccc6c6cc(-c7ccc8c9ccccc9c9ccccc9c8c7)ccc65)cc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c5cc(-n6c7ccccc7c7ccccc76)ccc5c5ccccc5c34)n2)cc1
InChIInChI=1S/C63H38N4.2C57H36N4.C51H32N4.C45H28N4/c1-3-15-39(16-4-1)61-64-62(40-17-5-2-6-18-40)66-63(65-61)43-28-32-53-56(37-43)50-24-12-10-22-48(50)52-33-30-44(38-57(52)53)67-59-26-14-13-25-54(59)58-36-42(29-34-60(58)67)41-27-31-51-47-21-8-7-19-45(47)46-20-9-11-23-49(46)55(51)35-41;1-5-17-37(18-6-1)41-31-33-45-46-34-32-42(38-19-7-2-8-20-38)36-52(46)61(51(45)35-41)50-30-16-28-48-44-26-14-13-25-43(44)47-27-15-29-49(53(47)54(48)50)57-59-55(39-21-9-3-10-22-39)58-56(60-57)40-23-11-4-12-24-40;1-5-16-37(17-6-1)41-28-32-52-50(34-41)51-35-42(38-18-7-2-8-19-38)29-33-53(51)61(52)43-30-31-45-44-24-13-14-25-46(44)54-47(49(45)36-43)26-15-27-48(54)57-59-55(39-20-9-3-10-21-39)58-56(60-57)40-22-11-4-12-23-40;1-4-14-33(15-5-1)36-24-28-44-43-22-12-13-23-47(43)55(48(44)31-36)38-26-29-41-39-20-10-11-21-40(39)45-30-37(25-27-42(45)46(41)32-38)51-53-49(34-16-6-2-7-17-34)52-50(54-51)35-18-8-3-9-19-35;1-3-14-29(15-4-1)43-46-44(30-16-5-2-6-17-30)48-45(47-43)38-23-13-22-37-39-28-31(26-27-33(39)32-18-7-8-21-36(32)42(37)38)49-40-24-11-9-19-34(40)35-20-10-12-25-41(35)49/h1-38H;2*1-36H;1-32H;1-28H
InChIKeyQSNUXBSSFMUCBH-UHFFFAOYSA-N
XLogP70.61
TPSA218.00 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds26
Heavy Atoms293
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003730.50
LogP ≤ 570.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze 9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole?
The IUPAC name of 9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole (CID 160507007) is 9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole.
What is the SMILES notation for 9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole?
The canonical SMILES for 9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole is c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc3c4ccccc4c4c(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cccc4c3c2)cc1.c1ccc(-c2ccc3c4ccc(-c5ccccc5)cc4n(-c4cccc5c6ccccc6c6cccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)c6c45)c3c2)cc1.c1ccc(-c2ccc3c4ccccc4n(-c4ccc5c6ccccc6c6cc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)ccc6c5c4)c3c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)c3ccccc3c3ccc(-n5c6ccccc6c6cc(-c7ccc8c9ccccc9c9ccccc9c8c7)ccc65)cc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c5cc(-n6c7ccccc7c7ccccc76)ccc5c5ccccc5c34)n2)cc1.
What is the InChIKey of 9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole?
The InChIKey is QSNUXBSSFMUCBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H38N4.2C57H36N4.C51H32N4.C45H28N4/c1-3-15-39(16-4-1)61-64-62(40-17-5-2-6-18-40)66-63(65-61)43-28-32-53-56(37-43)50-24-12-10-22-48(50)52-33-30-44(38-57(52)53)67-59-26-14-13-25-54(59)58-36-42(29-34-60(58)67)41-27-31-51-47-21-8-7-19-45(47)46-20-9-11-23-49(46)55(51)35-41;1-5-17-37(18-6-1)41-31-33-45-46-34-32-42(38-19-7-2-8-20-38)36-52(46)61(51(45)35-41)50-30-16-28-48-44-26-14-13-25-43(44)47-27-15-29-49(53(47)54(48)50)57-59-55(39-21-9-3-10-22-39)58-56(60-57)40-23-11-4-12-24-40;1-5-16-37(17-6-1)41-28-32-52-50(34-41)51-35-42(38-18-7-2-8-19-38)29-33-53(51)61(52)43-30-31-45-44-24-13-14-25-46(44)54-47(49(45)36-43)26-15-27-48(54)57-59-55(39-20-9-3-10-21-39)58-56(60-57)40-22-11-4-12-23-40;1-4-14-33(15-5-1)36-24-28-44-43-22-12-13-23-47(43)55(48(44)31-36)38-26-29-41-39-20-10-11-21-40(39)45-30-37(25-27-42(45)46(41)32-38)51-53-49(34-16-6-2-7-17-34)52-50(54-51)35-18-8-3-9-19-35;1-3-14-29(15-4-1)43-46-44(30-16-5-2-6-17-30)48-45(47-43)38-23-13-22-37-39-28-31(26-27-33(39)32-18-7-8-21-36(32)42(37)38)49-40-24-11-9-19-34(40)35-20-10-12-25-41(35)49/h1-38H;2*1-36H;1-32H;1-28H.
What are the key properties of 9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole?
9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole has a molecular weight of 3730.50 g/mol, XLogP of 70.61, 26 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]carbazole;9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,6-diphenylcarbazole;9-[12-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-2,7-diphenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2-phenylcarbazole;9-[10-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3-triphenylen-2-ylcarbazole is sourced from PubChem (CID 160507007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).