4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline

C203H125N9O3 — CID 160988890

About 4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline

4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline (PubChem CID 160988890) has the molecular formula C203H125N9O3 and a molecular weight of 2738.29 g/mol. Its IUPAC name is 4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline.

Molecular Properties

• Compound Name: 4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline
• PubChem CID: 160988890
• Molecular Formula: C203H125N9O3
• Molecular Weight: 2738.29 g/mol
• Exact Mass: 2735.99
• IUPAC Name: 4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline
• SMILES: c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)nc(-c2cccc3c2oc2ccccc23)c1.c1ccc(-c2ccc(-c3ccc4c5ccccc5c5ccccc5c4c3)cn2)nc1.c1ccc(-c2nc(-c3ccc4c5ccccc5c5ccccc5c4c3)nc3ccccc23)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c5ccccc5c5ccccc5c4c3)n2)cc1.c1ccc2c(c1)oc1c(-c3ccc4c5ccc(-c6cccc7c6oc6ccccc67)cc5c5ccccc5c4c3)cccc12.c1cnc2c(-c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)cccc2c1
• InChI: InChI=1S/C42H24O2.C35H21NO.C33H21N3.C33H21N.C32H20N2.C28H18N2/c1-2-10-30-29(9-1)37-23-25(27-13-7-15-35-33-11-3-5-17-39(33)43-41(27)35)19-21-31(37)32-22-20-26(24-38(30)32)28-14-8-16-36-34-12-4-6-18-40(34)44-42(28)36;1-2-11-25-23(9-1)24-10-3-4-12-26(24)31-21-22(19-20-27(25)31)32-16-8-17-33(36-32)30-15-7-14-29-28-13-5-6-18-34(28)37-35(29)30;1-3-11-22(12-4-1)31-34-32(23-13-5-2-6-14-23)36-33(35-31)24-19-20-29-27-17-8-7-15-25(27)26-16-9-10-18-28(26)30(29)21-24;1-2-11-29-27(9-1)28-10-3-4-12-30(28)32-21-25(18-19-31(29)32)22-14-16-23(17-15-22)26-13-5-7-24-8-6-20-34-33(24)26;1-2-10-21(11-3-1)31-28-16-8-9-17-30(28)33-32(34-31)22-18-19-27-25-14-5-4-12-23(25)24-13-6-7-15-26(24)29(27)20-22;1-2-9-23-21(7-1)22-8-3-4-10-24(22)26-17-19(12-14-25(23)26)20-13-15-28(30-18-20)27-11-5-6-16-29-27/h1-24H;1-21H;1-21H;1-21H;1-20H;1-18H
• InChIKey: TUIXMIHXNKDECS-UHFFFAOYSA-N
• XLogP: 55.11
• TPSA: 155.43 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 13
• Heavy Atoms: 215
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2738.29
LogP ≤ 5	55.11
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline?

The IUPAC name of 4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline (CID 160988890) is 4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline.

What is the SMILES notation for 4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline?

The canonical SMILES for 4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline is c1cc(-c2ccc3c4ccccc4c4ccccc4c3c2)nc(-c2cccc3c2oc2ccccc23)c1.c1ccc(-c2ccc(-c3ccc4c5ccccc5c5ccccc5c4c3)cn2)nc1.c1ccc(-c2nc(-c3ccc4c5ccccc5c5ccccc5c4c3)nc3ccccc23)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c5ccccc5c5ccccc5c4c3)n2)cc1.c1ccc2c(c1)oc1c(-c3ccc4c5ccc(-c6cccc7c6oc6ccccc67)cc5c5ccccc5c4c3)cccc12.c1cnc2c(-c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)cccc2c1.

What is the InChIKey of 4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline?

The InChIKey is TUIXMIHXNKDECS-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H24O2.C35H21NO.C33H21N3.C33H21N.C32H20N2.C28H18N2/c1-2-10-30-29(9-1)37-23-25(27-13-7-15-35-33-11-3-5-17-39(33)43-41(27)35)19-21-31(37)32-22-20-26(24-38(30)32)28-14-8-16-36-34-12-4-6-18-40(34)44-42(28)36;1-2-11-25-23(9-1)24-10-3-4-12-26(24)31-21-22(19-20-27(25)31)32-16-8-17-33(36-32)30-15-7-14-29-28-13-5-6-18-34(28)37-35(29)30;1-3-11-22(12-4-1)31-34-32(23-13-5-2-6-14-23)36-33(35-31)24-19-20-29-27-17-8-7-15-25(27)26-16-9-10-18-28(26)30(29)21-24;1-2-11-29-27(9-1)28-10-3-4-12-30(28)32-21-25(18-19-31(29)32)22-14-16-23(17-15-22)26-13-5-7-24-8-6-20-34-33(24)26;1-2-10-21(11-3-1)31-28-16-8-9-17-30(28)33-32(34-31)22-18-19-27-25-14-5-4-12-23(25)24-13-6-7-15-26(24)29(27)20-22;1-2-9-23-21(7-1)22-8-3-4-10-24(22)26-17-19(12-14-25(23)26)20-13-15-28(30-18-20)27-11-5-6-16-29-27/h1-24H;1-21H;1-21H;1-21H;1-20H;1-18H.

What are the key properties of 4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline?

4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline has a molecular weight of 2738.29 g/mol, XLogP of 55.11, 13 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran;2-dibenzofuran-4-yl-6-triphenylen-2-ylpyridine;2,4-diphenyl-6-triphenylen-2-yl-1,3,5-triazine;4-phenyl-2-triphenylen-2-ylquinazoline;2-pyridin-2-yl-5-triphenylen-2-ylpyridine;8-(4-triphenylen-2-ylphenyl)quinoline is sourced from PubChem (CID 160988890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).