8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene

C140H85N11O — CID 162081156

About 8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene

8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene (PubChem CID 162081156) has the molecular formula C140H85N11O and a molecular weight of 1937.30 g/mol. Its IUPAC name is 8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene.

Molecular Properties

• Compound Name: 8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene
• PubChem CID: 162081156
• Molecular Formula: C140H85N11O
• Molecular Weight: 1937.30 g/mol
• Exact Mass: 1935.69
• IUPAC Name: 8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene
• SMILES: c1ccc(-n2c3ccccc3c3cc(-c4nc5ccccc5nc4-c4ccc(N5c6ccccc6-c6cccc7cccc5c67)c5ccccc45)ccc32)cc1.c1ccc2c(c1)-c1cccc3cccc(c13)N2c1cc(-c2nc3ccccc3nc2-n2c3ccccc3c3ccccc32)c2ccccc2c1.c1ccc2c(c1)-c1cccc3cccc(c13)N2c1ccc(-c2nc3ccccc3nc2-c2cccc3c2oc2ccccc23)cc1
• InChI: InChI=1S/C52H32N4.C46H28N4.C42H25N3O/c1-2-16-35(17-3-1)55-45-25-10-7-21-39(45)42-32-34(28-30-48(42)55)51-52(54-44-24-9-8-23-43(44)53-51)41-29-31-47(37-19-5-4-18-36(37)41)56-46-26-11-6-20-38(46)40-22-12-14-33-15-13-27-49(56)50(33)40;1-2-16-32-30(13-1)27-31(49-40-23-8-5-19-35(40)36-20-11-14-29-15-12-26-43(49)44(29)36)28-37(32)45-46(48-39-22-7-6-21-38(39)47-45)50-41-24-9-3-17-33(41)34-18-4-10-25-42(34)50;1-5-19-36-29(12-1)31-14-7-10-26-11-8-20-37(39(26)31)45(36)28-24-22-27(23-25-28)40-41(44-35-18-4-3-17-34(35)43-40)33-16-9-15-32-30-13-2-6-21-38(30)46-42(32)33/h1-32H;1-28H;1-25H
• InChIKey: ZCJBLPGUFQKZBP-UHFFFAOYSA-N
• XLogP: 37.43
• TPSA: 110.06 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 10
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1937.30
LogP ≤ 5	37.43
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene?

The IUPAC name of 8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene (CID 162081156) is 8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene.

What is the SMILES notation for 8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene?

The canonical SMILES for 8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene is c1ccc(-n2c3ccccc3c3cc(-c4nc5ccccc5nc4-c4ccc(N5c6ccccc6-c6cccc7cccc5c67)c5ccccc45)ccc32)cc1.c1ccc2c(c1)-c1cccc3cccc(c13)N2c1cc(-c2nc3ccccc3nc2-n2c3ccccc3c3ccccc32)c2ccccc2c1.c1ccc2c(c1)-c1cccc3cccc(c13)N2c1ccc(-c2nc3ccccc3nc2-c2cccc3c2oc2ccccc23)cc1.

What is the InChIKey of 8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene?

The InChIKey is ZCJBLPGUFQKZBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H32N4.C46H28N4.C42H25N3O/c1-2-16-35(17-3-1)55-45-25-10-7-21-39(45)42-32-34(28-30-48(42)55)51-52(54-44-24-9-8-23-43(44)53-51)41-29-31-47(37-19-5-4-18-36(37)41)56-46-26-11-6-20-38(46)40-22-12-14-33-15-13-27-49(56)50(33)40;1-2-16-32-30(13-1)27-31(49-40-23-8-5-19-35(40)36-20-11-14-29-15-12-26-43(49)44(29)36)28-37(32)45-46(48-39-22-7-6-21-38(39)47-45)50-41-24-9-3-17-33(41)34-18-4-10-25-42(34)50;1-5-19-36-29(12-1)31-14-7-10-26-11-8-20-37(39(26)31)45(36)28-24-22-27(23-25-28)40-41(44-35-18-4-3-17-34(35)43-40)33-16-9-15-32-30-13-2-6-21-38(30)46-42(32)33/h1-32H;1-28H;1-25H.

What are the key properties of 8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene?

8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene has a molecular weight of 1937.30 g/mol, XLogP of 37.43, 10 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 8-[4-(3-carbazol-9-ylquinoxalin-2-yl)naphthalen-2-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-(3-dibenzofuran-4-ylquinoxalin-2-yl)phenyl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;8-[4-[3-(9-phenylcarbazol-3-yl)quinoxalin-2-yl]naphthalen-1-yl]-8-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene is sourced from PubChem (CID 162081156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).