8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole

C174H107N19OS — CID 158361264

About 8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole

8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole (PubChem CID 158361264) has the molecular formula C174H107N19OS and a molecular weight of 2511.97 g/mol. Its IUPAC name is 8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole.

Molecular Properties

• Compound Name: 8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole
• PubChem CID: 158361264
• Molecular Formula: C174H107N19OS
• Molecular Weight: 2511.97 g/mol
• Exact Mass: 2509.86
• IUPAC Name: 8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole
• SMILES: c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7cccc(-c8ccc9c(c8)c8ncccc8n9-c8ccccc8)c7)c6c5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7cccc(-c8ccc9oc%10cccnc%10c9c8)c7)c6c5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7cccc(-c8ccc9sc%10cccnc%10c9c8)c7)c6c5)ccc43)n2)cc1
• InChI: InChI=1S/C62H39N7.C56H34N6O.C56H34N6S/c1-4-16-40(17-5-1)60-64-61(41-18-6-2-7-19-41)66-62(65-60)69-54-27-13-11-25-49(54)51-37-43(30-33-55(51)69)45-29-32-50-48-24-10-12-26-53(48)68(58(50)39-45)47-23-14-20-42(36-47)44-31-34-56-52(38-44)59-57(28-15-35-63-59)67(56)46-21-8-3-9-22-46;2*1-3-13-35(14-4-1)54-58-55(36-15-5-2-6-16-36)60-56(59-54)62-48-22-10-8-20-43(48)45-32-38(25-28-49(45)62)40-24-27-44-42-19-7-9-21-47(42)61(50(44)34-40)41-18-11-17-37(31-41)39-26-29-51-46(33-39)53-52(63-51)23-12-30-57-53/h1-39H;2*1-34H
• InChIKey: GTMPOHXTNOQXKX-UHFFFAOYSA-N
• XLogP: 43.75
• TPSA: 202.33 Ų
• H-Bond Acceptors: 21
• Rotatable Bonds: 19
• Heavy Atoms: 195
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2511.97
LogP ≤ 5	43.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of 8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole?

The IUPAC name of 8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole (CID 158361264) is 8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole.

What is the SMILES notation for 8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole?

The canonical SMILES for 8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole is c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7cccc(-c8ccc9c(c8)c8ncccc8n9-c8ccccc8)c7)c6c5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7cccc(-c8ccc9oc%10cccnc%10c9c8)c7)c6c5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7cccc(-c8ccc9sc%10cccnc%10c9c8)c7)c6c5)ccc43)n2)cc1.

What is the InChIKey of 8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole?

The InChIKey is GTMPOHXTNOQXKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H39N7.C56H34N6O.C56H34N6S/c1-4-16-40(17-5-1)60-64-61(41-18-6-2-7-19-41)66-62(65-60)69-54-27-13-11-25-49(54)51-37-43(30-33-55(51)69)45-29-32-50-48-24-10-12-26-53(48)68(58(50)39-45)47-23-14-20-42(36-47)44-31-34-56-52(38-44)59-57(28-15-35-63-59)67(56)46-21-8-3-9-22-46;2*1-3-13-35(14-4-1)54-58-55(36-15-5-2-6-16-36)60-56(59-54)62-48-22-10-8-20-43(48)45-32-38(25-28-49(45)62)40-24-27-44-42-19-7-9-21-47(42)61(50(44)34-40)41-18-11-17-37(31-41)39-26-29-51-46(33-39)53-52(63-51)23-12-30-57-53/h1-39H;2*1-34H.

What are the key properties of 8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole?

8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole has a molecular weight of 2511.97 g/mol, XLogP of 43.75, 19 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzofuro[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-[1]benzothiolo[3,2-b]pyridine;8-[3-[2-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]-5-phenylpyrido[3,2-b]indole is sourced from PubChem (CID 158361264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).