8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline

C202H124N10S5 — CID 167698067

About 8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline

8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline (PubChem CID 167698067) has the molecular formula C202H124N10S5 and a molecular weight of 2851.62 g/mol. Its IUPAC name is 8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline.

Molecular Properties

• Compound Name: 8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline
• PubChem CID: 167698067
• Molecular Formula: C202H124N10S5
• Molecular Weight: 2851.62 g/mol
• Exact Mass: 2848.86
• IUPAC Name: 8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline
• SMILES: c1ccc(-c2ccc(-c3nc(-c4cccc(-c5cccc6sc7ccccc7c56)c4)nc4c3ccc3ccccc34)cc2)cc1.c1ccc(-c2ccc(-c3nc4ccc5ccccc5c4nc3-c3ccc(-c4cccc5sc6ccccc6c45)cc3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccc6sc7ccccc7c6c5)cc4)c4ccc5ccccc5c4n3)c2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc6sc7ccccc7c56)ccc4c3nc2-c2ccccc2)cc1.c1ccc2cc(-c3ccc(-c4nc5ccc6ccccc6c5nc4-c4cccc5sc6ccccc6c45)cc3)ccc2c1
• InChI: InChI=1S/3C42H26N2S.C40H24N2S.C36H22N2S/c1-2-10-27(11-3-1)28-20-22-30(23-21-28)40-36-25-24-29-12-4-5-15-34(29)41(36)44-42(43-40)32-14-8-13-31(26-32)33-17-9-19-38-39(33)35-16-6-7-18-37(35)45-38;1-2-9-27(10-3-1)31-12-8-13-33(25-31)42-43-40(36-23-21-29-11-4-5-14-34(29)41(36)44-42)30-19-17-28(18-20-30)32-22-24-39-37(26-32)35-15-6-7-16-38(35)45-39;1-2-9-27(10-3-1)28-17-21-31(22-18-28)40-41(44-42-34-12-5-4-11-29(34)25-26-36(42)43-40)32-23-19-30(20-24-32)33-14-8-16-38-39(33)35-13-6-7-15-37(35)45-38;1-2-10-29-24-30(21-18-25(29)8-1)26-16-19-28(20-17-26)38-40(42-39-31-11-4-3-9-27(31)22-23-34(39)41-38)33-13-7-15-36-37(33)32-12-5-6-14-35(32)43-36;1-3-10-23(11-4-1)34-35(24-12-5-2-6-13-24)38-36-28-20-18-25(22-26(28)19-21-30(36)37-34)27-15-9-17-32-33(27)29-14-7-8-16-31(29)39-32/h3*1-26H;1-24H;1-22H
• InChIKey: XYSQNHQASVNUJW-UHFFFAOYSA-N
• XLogP: 56.91
• TPSA: 128.90 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 18
• Heavy Atoms: 217
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2851.62
LogP ≤ 5	56.91
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline?

The IUPAC name of 8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline (CID 167698067) is 8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline.

What is the SMILES notation for 8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline?

The canonical SMILES for 8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline is c1ccc(-c2ccc(-c3nc(-c4cccc(-c5cccc6sc7ccccc7c56)c4)nc4c3ccc3ccccc34)cc2)cc1.c1ccc(-c2ccc(-c3nc4ccc5ccccc5c4nc3-c3ccc(-c4cccc5sc6ccccc6c45)cc3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccc6sc7ccccc7c6c5)cc4)c4ccc5ccccc5c4n3)c2)cc1.c1ccc(-c2nc3ccc4cc(-c5cccc6sc7ccccc7c56)ccc4c3nc2-c2ccccc2)cc1.c1ccc2cc(-c3ccc(-c4nc5ccc6ccccc6c5nc4-c4cccc5sc6ccccc6c45)cc3)ccc2c1.

What is the InChIKey of 8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline?

The InChIKey is XYSQNHQASVNUJW-UHFFFAOYSA-N. The full InChI is InChI=1S/3C42H26N2S.C40H24N2S.C36H22N2S/c1-2-10-27(11-3-1)28-20-22-30(23-21-28)40-36-25-24-29-12-4-5-15-34(29)41(36)44-42(43-40)32-14-8-13-31(26-32)33-17-9-19-38-39(33)35-16-6-7-18-37(35)45-38;1-2-9-27(10-3-1)31-12-8-13-33(25-31)42-43-40(36-23-21-29-11-4-5-14-34(29)41(36)44-42)30-19-17-28(18-20-30)32-22-24-39-37(26-32)35-15-6-7-16-38(35)45-39;1-2-9-27(10-3-1)28-17-21-31(22-18-28)40-41(44-42-34-12-5-4-11-29(34)25-26-36(42)43-40)32-23-19-30(20-24-32)33-14-8-16-38-39(33)35-13-6-7-15-37(35)45-38;1-2-10-29-24-30(21-18-25(29)8-1)26-16-19-28(20-17-26)38-40(42-39-31-11-4-3-9-27(31)22-23-34(39)41-38)33-13-7-15-36-37(33)32-12-5-6-14-35(32)43-36;1-3-10-23(11-4-1)34-35(24-12-5-2-6-13-24)38-36-28-20-18-25(22-26(28)19-21-30(36)37-34)27-15-9-17-32-33(27)29-14-7-8-16-31(29)39-32/h3*1-26H;1-24H;1-22H.

What are the key properties of 8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline?

8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline has a molecular weight of 2851.62 g/mol, XLogP of 56.91, 18 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 8-dibenzothiophen-1-yl-2,3-diphenylbenzo[f]quinoxaline;2-dibenzothiophen-1-yl-3-(4-naphthalen-2-ylphenyl)benzo[f]quinoxaline;2-(4-dibenzothiophen-1-ylphenyl)-3-(4-phenylphenyl)benzo[f]quinoxaline;2-(3-dibenzothiophen-1-ylphenyl)-4-(4-phenylphenyl)benzo[h]quinazoline;4-(4-dibenzothiophen-2-ylphenyl)-2-(3-phenylphenyl)benzo[h]quinazoline is sourced from PubChem (CID 167698067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).