5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole

C183H105N13O6 — CID 164962466

About 5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole

5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole (PubChem CID 164962466) has the molecular formula C183H105N13O6 and a molecular weight of 2581.94 g/mol. Its IUPAC name is 5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole.

Molecular Properties

• Compound Name: 5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole
• PubChem CID: 164962466
• Molecular Formula: C183H105N13O6
• Molecular Weight: 2581.94 g/mol
• Exact Mass: 2579.83
• IUPAC Name: 5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole
• SMILES: c1ccc(-c2ccc(-c3nc(-c4cccc5c4oc4ccccc45)nc(-c4ccc(-n5c6cc7ccccc7cc6c6cc7ccccc7cc65)c5oc6ccccc6c45)n3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4cccc5c4oc4ccccc45)nc(-c4ccc(-n5c6ccccc6c6cc7ccccc7cc65)c5oc6c7ccccc7ccc6c45)n3)c2)cc1.c1ccc(-n2c3ccccc3c3cccc(-c4nc(-c5cccc6c5oc5ccccc56)nc(-c5ccc(-n6c7ccccc7c7cc8ccccc8cc76)c6oc7cc8ccccc8cc7c56)n4)c32)cc1
• InChI: InChI=1S/C65H37N5O2.2C59H34N4O2/c1-2-20-42(21-3-1)69-53-29-11-8-22-43(53)46-25-14-27-49(60(46)69)64-66-63(67-65(68-64)50-28-15-26-47-45-24-10-13-31-57(45)71-61(47)50)48-32-33-55(62-59(48)52-35-39-17-5-7-19-41(39)37-58(52)72-62)70-54-30-12-9-23-44(54)51-34-38-16-4-6-18-40(38)36-56(51)70;1-2-13-35(14-3-1)36-25-27-37(28-26-36)57-60-58(62-59(61-57)46-22-12-21-43-42-19-8-10-23-52(42)64-55(43)46)45-29-30-49(56-54(45)44-20-9-11-24-53(44)65-56)63-50-33-40-17-6-4-15-38(40)31-47(50)48-32-39-16-5-7-18-41(39)34-51(48)63;1-2-14-35(15-3-1)37-19-12-20-40(32-37)57-60-58(62-59(61-57)47-25-13-24-44-43-23-9-11-27-52(43)64-55(44)47)46-30-31-50(56-53(46)45-29-28-36-16-6-7-21-41(36)54(45)65-56)63-49-26-10-8-22-42(49)48-33-38-17-4-5-18-39(38)34-51(48)63/h1-37H;2*1-34H
• InChIKey: CAKFHYXPRQTJBY-UHFFFAOYSA-N
• XLogP: 48.66
• TPSA: 214.57 Ų
• H-Bond Acceptors: 19
• Rotatable Bonds: 15
• Heavy Atoms: 202
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2581.94
LogP ≤ 5	48.66
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of 5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole?

The IUPAC name of 5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole (CID 164962466) is 5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole.

What is the SMILES notation for 5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole?

The canonical SMILES for 5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole is c1ccc(-c2ccc(-c3nc(-c4cccc5c4oc4ccccc45)nc(-c4ccc(-n5c6cc7ccccc7cc6c6cc7ccccc7cc65)c5oc6ccccc6c45)n3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4cccc5c4oc4ccccc45)nc(-c4ccc(-n5c6ccccc6c6cc7ccccc7cc65)c5oc6c7ccccc7ccc6c45)n3)c2)cc1.c1ccc(-n2c3ccccc3c3cccc(-c4nc(-c5cccc6c5oc5ccccc56)nc(-c5ccc(-n6c7ccccc7c7cc8ccccc8cc76)c6oc7cc8ccccc8cc7c56)n4)c32)cc1.

What is the InChIKey of 5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole?

The InChIKey is CAKFHYXPRQTJBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H37N5O2.2C59H34N4O2/c1-2-20-42(21-3-1)69-53-29-11-8-22-43(53)46-25-14-27-49(60(46)69)64-66-63(67-65(68-64)50-28-15-26-47-45-24-10-13-31-57(45)71-61(47)50)48-32-33-55(62-59(48)52-35-39-17-5-7-19-41(39)37-58(52)72-62)70-54-30-12-9-23-44(54)51-34-38-16-4-6-18-40(38)36-56(51)70;1-2-13-35(14-3-1)36-25-27-37(28-26-36)57-60-58(62-59(61-57)46-22-12-21-43-42-19-8-10-23-52(42)64-55(43)46)45-29-30-49(56-54(45)44-20-9-11-24-53(44)65-56)63-50-33-40-17-6-4-15-38(40)31-47(50)48-32-39-16-5-7-18-41(39)34-51(48)63;1-2-14-35(15-3-1)37-19-12-20-40(32-37)57-60-58(62-59(61-57)47-25-13-24-44-43-23-9-11-27-52(43)64-55(44)47)46-30-31-50(56-53(46)45-29-28-36-16-6-7-21-41(36)54(45)65-56)63-49-26-10-8-22-42(49)48-33-38-17-4-5-18-39(38)34-51(48)63/h1-37H;2*1-34H.

What are the key properties of 5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole?

5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole has a molecular weight of 2581.94 g/mol, XLogP of 48.66, 15 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[1-[4-dibenzofuran-4-yl-6-(9-phenylcarbazol-1-yl)-1,3,5-triazin-2-yl]naphtho[2,3-b][1]benzofuran-4-yl]benzo[b]carbazole;12-[1-[4-dibenzofuran-4-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[7-[4-dibenzofuran-4-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphtho[1,2-b][1]benzofuran-10-yl]benzo[b]carbazole is sourced from PubChem (CID 164962466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).