8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole

C57H34N8 — CID 144612460

About 8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole

8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole (PubChem CID 144612460) has the molecular formula C57H34N8 and a molecular weight of 830.96 g/mol. Its IUPAC name is 8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole.

Molecular Properties

• Compound Name: 8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole
• PubChem CID: 144612460
• Molecular Formula: C57H34N8
• Molecular Weight: 830.96 g/mol
• Exact Mass: 830.29
• IUPAC Name: 8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole
• SMILES: c1cc2c(c(-n3c4ccc(-n5c6ccccc6c6ncccc65)cc4c4ncccc43)c1)Cc1ccc(-n3c4ccc(-n5c6ccccc6c6ncccc65)cc4c4ncccc43)cc1-2
• InChI: InChI=1S/C57H34N8/c1-3-13-45-39(10-1)54-50(16-6-26-58-54)62(45)36-22-24-48-43(32-36)56-52(18-8-28-60-56)64(48)35-21-20-34-30-42-38(41(34)31-35)12-5-15-47(42)65-49-25-23-37(33-44(49)57-53(65)19-9-29-61-57)63-46-14-4-2-11-40(46)55-51(63)17-7-27-59-55/h1-29,31-33H,30H2
• InChIKey: ZYVXNUGSMBPDPL-UHFFFAOYSA-N
• XLogP: 13.23
• TPSA: 71.28 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 4
• Heavy Atoms: 65
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	830.96
LogP ≤ 5	13.23
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole?

The IUPAC name of 8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole (CID 144612460) is 8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole.

What is the SMILES notation for 8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole?

The canonical SMILES for 8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole is c1cc2c(c(-n3c4ccc(-n5c6ccccc6c6ncccc65)cc4c4ncccc43)c1)Cc1ccc(-n3c4ccc(-n5c6ccccc6c6ncccc65)cc4c4ncccc43)cc1-2.

What is the InChIKey of 8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole?

The InChIKey is ZYVXNUGSMBPDPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H34N8/c1-3-13-45-39(10-1)54-50(16-6-26-58-54)62(45)36-22-24-48-43(32-36)56-52(18-8-28-60-56)64(48)35-21-20-34-30-42-38(41(34)31-35)12-5-15-47(42)65-49-25-23-37(33-44(49)57-53(65)19-9-29-61-57)63-46-14-4-2-11-40(46)55-51(63)17-7-27-59-55/h1-29,31-33H,30H2.

What are the key properties of 8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole?

8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole has a molecular weight of 830.96 g/mol, XLogP of 13.23, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 8-pyrido[3,2-b]indol-5-yl-5-[6-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)-9H-fluoren-1-yl]pyrido[3,2-b]indole is sourced from PubChem (CID 144612460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).