5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole

C155H100N12 — CID 159926626

IUPAC5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2c(-c4cc5ccccc5cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)c2c(-c4ccc5c6ccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)cc6c6ccccc6c5c4)cccc2n3-c2ccccc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc5c4c4c(-c6cccc7ccccc67)cccc4n5-c4ccccc4)c3)n2)cc1
InChIInChI=1S/C57H36N4.2C49H32N4/c1-5-16-37(17-6-1)40-30-33-52-51(34-40)54-44(26-15-27-53(54)61(52)43-22-11-4-12-23-43)41-28-31-47-48-32-29-42(36-50(48)46-25-14-13-24-45(46)49(47)35-41)57-59-55(38-18-7-2-8-19-38)58-56(60-57)39-20-9-3-10-21-39;1-5-16-33(17-6-1)38-28-29-44-43(32-38)46-40(26-15-27-45(46)53(44)39-24-11-4-12-25-39)41-30-36-22-13-14-23-37(36)31-42(41)49-51-47(34-18-7-2-8-19-34)50-48(52-49)35-20-9-3-10-21-35;1-4-17-34(18-5-1)47-50-48(35-19-6-2-7-20-35)52-49(51-47)37-23-12-22-36(32-37)40-27-14-30-43-45(40)46-42(41-28-13-21-33-16-10-11-26-39(33)41)29-15-31-44(46)53(43)38-24-8-3-9-25-38/h1-36H;2*1-32H
InChIKeyNZCBWKLWZBYJJN-UHFFFAOYSA-N
MW2130.59 g/mol
LogP39.68
Rot. Bonds18

About 5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole

5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole (PubChem CID 159926626) has the molecular formula C155H100N12 and a molecular weight of 2130.59 g/mol. Its IUPAC name is 5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole.

Molecular Properties

Compound Name5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole
PubChem CID159926626
Molecular FormulaC155H100N12
Molecular Weight2130.59 g/mol
Exact Mass2128.82
IUPAC Name5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole
SMILESc1ccc(-c2ccc3c(c2)c2c(-c4cc5ccccc5cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)c2c(-c4ccc5c6ccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)cc6c6ccccc6c5c4)cccc2n3-c2ccccc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc5c4c4c(-c6cccc7ccccc67)cccc4n5-c4ccccc4)c3)n2)cc1
InChIInChI=1S/C57H36N4.2C49H32N4/c1-5-16-37(17-6-1)40-30-33-52-51(34-40)54-44(26-15-27-53(54)61(52)43-22-11-4-12-23-43)41-28-31-47-48-32-29-42(36-50(48)46-25-14-13-24-45(46)49(47)35-41)57-59-55(38-18-7-2-8-19-38)58-56(60-57)39-20-9-3-10-21-39;1-5-16-33(17-6-1)38-28-29-44-43(32-38)46-40(26-15-27-45(46)53(44)39-24-11-4-12-25-39)41-30-36-22-13-14-23-37(36)31-42(41)49-51-47(34-18-7-2-8-19-34)50-48(52-49)35-20-9-3-10-21-35;1-4-17-34(18-5-1)47-50-48(35-19-6-2-7-20-35)52-49(51-47)37-23-12-22-36(32-37)40-27-14-30-43-45(40)46-42(41-28-13-21-33-16-10-11-26-39(33)41)29-15-31-44(46)53(43)38-24-8-3-9-25-38/h1-36H;2*1-32H
InChIKeyNZCBWKLWZBYJJN-UHFFFAOYSA-N
XLogP39.68
TPSA130.80 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds18
Heavy Atoms167
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002130.59
LogP ≤ 539.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

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

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Related Compounds

5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-2-yl-9-phenylcarbazole
CID 159301460
5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-2,9-diphenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole
CID 158650135
5-[3-[4,6-bis[3-(3,5-diphenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]-3,9-diphenylcarbazole
CID 129265295
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenanthren-3-yl-9-phenylcarbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenyl-3-triphenylen-2-ylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-1,9-diphenylcarbazole
CID 158193193
4-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenanthren-2-yl-9-phenylcarbazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-phenanthren-9-yl-9-phenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-2-yl-9-phenylcarbazole
CID 158116444
5-[3-[4-(2-carbazol-9-yl-4-phenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-3,9-diphenylcarbazole
CID 139303805
3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazin-2-yl]carbazol-3-yl]-9-phenylcarbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]carbazole;3-[9-[4-naphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-phenylcarbazole
CID 160712276
3-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenyl-5-(9-phenylcarbazol-3-yl)carbazole
CID 134597683
5-[3-(4-dibenzothiophen-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-3,9-diphenylcarbazole
CID 146572715
5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-9-phenyl-3-[9-phenyl-7-[4-[6-phenyl-2-[3-[9-phenyl-7-(9-phenylcarbazol-2-yl)carbazol-4-yl]phenyl]pyrimidin-4-yl]phenyl]carbazol-3-yl]carbazole
CID 155039415
1-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]triphenylen-2-yl]-9-phenylcarbazole;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]triphenylen-2-yl]-9-phenylcarbazole;3-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]triphenylen-2-yl]-9-phenylcarbazole;4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]triphenylen-2-yl]-9-phenylcarbazole;9-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]triphenylen-2-yl]-3-phenylcarbazole;9-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]triphenylen-2-yl]-4-phenylcarbazole
CID 163557300
5-[4-[4-(9-phenylcarbazol-4-yl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]benzo[b]carbazole
CID 146621071

Frequently Asked Questions

What is the IUPAC name of 5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole?
The IUPAC name of 5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole (CID 159926626) is 5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole.
What is the SMILES notation for 5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole?
The canonical SMILES for 5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole is c1ccc(-c2ccc3c(c2)c2c(-c4cc5ccccc5cc4-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cccc2n3-c2ccccc2)cc1.c1ccc(-c2ccc3c(c2)c2c(-c4ccc5c6ccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)cc6c6ccccc6c5c4)cccc2n3-c2ccccc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc5c4c4c(-c6cccc7ccccc67)cccc4n5-c4ccccc4)c3)n2)cc1.
What is the InChIKey of 5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole?
The InChIKey is NZCBWKLWZBYJJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H36N4.2C49H32N4/c1-5-16-37(17-6-1)40-30-33-52-51(34-40)54-44(26-15-27-53(54)61(52)43-22-11-4-12-23-43)41-28-31-47-48-32-29-42(36-50(48)46-25-14-13-24-45(46)49(47)35-41)57-59-55(38-18-7-2-8-19-38)58-56(60-57)39-20-9-3-10-21-39;1-5-16-33(17-6-1)38-28-29-44-43(32-38)46-40(26-15-27-45(46)53(44)39-24-11-4-12-25-39)41-30-36-22-13-14-23-37(36)31-42(41)49-51-47(34-18-7-2-8-19-34)50-48(52-49)35-20-9-3-10-21-35;1-4-17-34(18-5-1)47-50-48(35-19-6-2-7-20-35)52-49(51-47)37-23-12-22-36(32-37)40-27-14-30-43-45(40)46-42(41-28-13-21-33-16-10-11-26-39(33)41)29-15-31-44(46)53(43)38-24-8-3-9-25-38/h1-36H;2*1-32H.
What are the key properties of 5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole?
5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole has a molecular weight of 2130.59 g/mol, XLogP of 39.68, 18 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-3,9-diphenylcarbazole;4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-naphthalen-1-yl-9-phenylcarbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-2-yl]-3,9-diphenylcarbazole is sourced from PubChem (CID 159926626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).