5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole

C145H90N12 — CID 161263808

IUPAC5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4ccc5cc(-c6nc(-c7cccc8ccccc78)nc(-c7cc8ccccc8c8ccccc78)n6)ccc5c43)cc2)cc1.c1ccc(-c2nc(-c3cccc4ccccc34)nc(-c3cccc4ccc5c6ccccc6n(-c6ccccc6)c5c34)n2)cc1.c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cc5c6ccccc6n(-c6ccc7ccccc7c6)c5c5ccccc45)n3)ccc2c1
InChIInChI=1S/C55H34N4.C49H30N4.C41H26N4/c1-2-13-35(14-3-1)36-25-29-41(30-26-36)59-51-24-11-10-22-47(51)48-32-27-39-33-40(28-31-44(39)52(48)59)53-56-54(49-23-12-17-37-15-4-6-18-42(37)49)58-55(57-53)50-34-38-16-5-7-19-43(38)45-20-8-9-21-46(45)50;1-4-14-34-27-37(23-21-31(34)11-1)47-50-48(38-24-22-32-12-2-5-15-35(32)28-38)52-49(51-47)44-30-43-41-18-9-10-20-45(41)53(46(43)42-19-8-7-17-40(42)44)39-26-25-33-13-3-6-16-36(33)29-39;1-3-14-29(15-4-1)39-42-40(34-22-11-16-27-13-7-8-20-31(27)34)44-41(43-39)35-23-12-17-28-25-26-33-32-21-9-10-24-36(32)45(38(33)37(28)35)30-18-5-2-6-19-30/h1-34H;1-30H;1-26H
InChIKeyVCXFYZQRDHUZFF-UHFFFAOYSA-N
MW2000.40 g/mol
LogP37.11
Rot. Bonds13

About 5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole

5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole (PubChem CID 161263808) has the molecular formula C145H90N12 and a molecular weight of 2000.40 g/mol. Its IUPAC name is 5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole.

Molecular Properties

Compound Name5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole
PubChem CID161263808
Molecular FormulaC145H90N12
Molecular Weight2000.40 g/mol
Exact Mass1998.74
IUPAC Name5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4ccc5cc(-c6nc(-c7cccc8ccccc78)nc(-c7cc8ccccc8c8ccccc78)n6)ccc5c43)cc2)cc1.c1ccc(-c2nc(-c3cccc4ccccc34)nc(-c3cccc4ccc5c6ccccc6n(-c6ccccc6)c5c34)n2)cc1.c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cc5c6ccccc6n(-c6ccc7ccccc7c6)c5c5ccccc45)n3)ccc2c1
InChIInChI=1S/C55H34N4.C49H30N4.C41H26N4/c1-2-13-35(14-3-1)36-25-29-41(30-26-36)59-51-24-11-10-22-47(51)48-32-27-39-33-40(28-31-44(39)52(48)59)53-56-54(49-23-12-17-37-15-4-6-18-42(37)49)58-55(57-53)50-34-38-16-5-7-19-43(38)45-20-8-9-21-46(45)50;1-4-14-34-27-37(23-21-31(34)11-1)47-50-48(38-24-22-32-12-2-5-15-35(32)28-38)52-49(51-47)44-30-43-41-18-9-10-20-45(41)53(46(43)42-19-8-7-17-40(42)44)39-26-25-33-13-3-6-16-36(33)29-39;1-3-14-29(15-4-1)39-42-40(34-22-11-16-27-13-7-8-20-31(27)34)44-41(43-39)35-23-12-17-28-25-26-33-32-21-9-10-24-36(32)45(38(33)37(28)35)30-18-5-2-6-19-30/h1-34H;1-30H;1-26H
InChIKeyVCXFYZQRDHUZFF-UHFFFAOYSA-N
XLogP37.11
TPSA130.80 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds13
Heavy Atoms157
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002000.40
LogP ≤ 537.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze 5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole with MolForge

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Related Compounds

9-[5-(4-chrysen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole
CID 170109199
22-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-12-naphthalen-2-yl-12,22-diazahexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-24-phenyl-9,24-diazahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaene;22-[5-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-12-phenyl-12,22-diazahexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene
CID 158569243
5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-12-naphthalen-2-ylindolo[3,2-c]carbazole
CID 156530949
11-[4-[4-phenyl-6-(6-phenylnaphthalen-2-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]benzo[a]carbazole
CID 167031798
16-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-4,12-diphenyl-12,16-diazahexacyclo[11.11.0.02,11.05,10.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene;16-[5-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-12-phenyl-12,16-diazahexacyclo[11.11.0.02,11.05,10.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene;12-phenyl-16-[5-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12,16-diazahexacyclo[11.11.0.02,11.05,10.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 161392177
11-[4-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]benzo[a]carbazole
CID 167032232
11-(9,9-dimethylfluoren-2-yl)-2-[4-naphthalen-2-yl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]benzo[a]carbazole;4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole;2-(3-naphtho[1,2-b][1]benzofuran-5-ylphenyl)-4-phenanthren-9-yl-6-phenyl-1,3,5-triazine;11-phenyl-5-[4-(2-phenylphenyl)-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]benzo[a]carbazole
CID 162149825
11-[3-[2-[4-phenyl-6-(6-phenylnaphthalen-2-yl)-1,3,5-triazin-2-yl]phenyl]phenyl]benzo[a]carbazole
CID 167031915
2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole
CID 155477033
1-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)-9-phenylcarbazole
CID 139342063
11-[3-(4-benzo[c]phenanthren-5-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]benzo[a]carbazole
CID 170109345
5-[4-[4-naphthalen-2-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]phenyl]benzo[b]carbazole;5-[4-[4-naphthalen-2-yl-6-(9-phenylcarbazol-2-yl)-1,3,5-triazin-2-yl]phenyl]benzo[b]carbazole;5-[4-[4-phenyl-6-(9-phenylcarbazol-4-yl)-1,3,5-triazin-2-yl]phenyl]benzo[b]carbazole
CID 161196328

Frequently Asked Questions

What is the IUPAC name of 5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole?
The IUPAC name of 5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole (CID 161263808) is 5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole.
What is the SMILES notation for 5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole?
The canonical SMILES for 5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole is c1ccc(-c2ccc(-n3c4ccccc4c4ccc5cc(-c6nc(-c7cccc8ccccc78)nc(-c7cc8ccccc8c8ccccc78)n6)ccc5c43)cc2)cc1.c1ccc(-c2nc(-c3cccc4ccccc34)nc(-c3cccc4ccc5c6ccccc6n(-c6ccccc6)c5c34)n2)cc1.c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4cc5c6ccccc6n(-c6ccc7ccccc7c6)c5c5ccccc45)n3)ccc2c1.
What is the InChIKey of 5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole?
The InChIKey is VCXFYZQRDHUZFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H34N4.C49H30N4.C41H26N4/c1-2-13-35(14-3-1)36-25-29-41(30-26-36)59-51-24-11-10-22-47(51)48-32-27-39-33-40(28-31-44(39)52(48)59)53-56-54(49-23-12-17-37-15-4-6-18-42(37)49)58-55(57-53)50-34-38-16-5-7-19-43(38)45-20-8-9-21-46(45)50;1-4-14-34-27-37(23-21-31(34)11-1)47-50-48(38-24-22-32-12-2-5-15-35(32)28-38)52-49(51-47)44-30-43-41-18-9-10-20-45(41)53(46(43)42-19-8-7-17-40(42)44)39-26-25-33-13-3-6-16-36(33)29-39;1-3-14-29(15-4-1)39-42-40(34-22-11-16-27-13-7-8-20-31(27)34)44-41(43-39)35-23-12-17-28-25-26-33-32-21-9-10-24-36(32)45(38(33)37(28)35)30-18-5-2-6-19-30/h1-34H;1-30H;1-26H.
What are the key properties of 5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole?
5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole has a molecular weight of 2000.40 g/mol, XLogP of 37.11, 13 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-11-naphthalen-2-ylbenzo[a]carbazole;3-(4-naphthalen-1-yl-6-phenanthren-9-yl-1,3,5-triazin-2-yl)-11-(4-phenylphenyl)benzo[a]carbazole;1-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)-11-phenylbenzo[a]carbazole is sourced from PubChem (CID 161263808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).