7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine

C107H70N6O3 — CID 158322002

About 7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine

7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine (PubChem CID 158322002) has the molecular formula C107H70N6O3 and a molecular weight of 1487.78 g/mol. Its IUPAC name is 7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine.

Molecular Properties

• Compound Name: 7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine
• PubChem CID: 158322002
• Molecular Formula: C107H70N6O3
• Molecular Weight: 1487.78 g/mol
• Exact Mass: 1486.55
• IUPAC Name: 7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine
• SMILES: Cc1cc(C)c2oc3c(C)cc(-c4ccccc4-c4ccc5c(c4)c4ccccc4c4nccnc54)cc3c2c1.Cc1cnc2c3ccc(-c4cccc(-c5ccc6oc7ccccc7c6c5)c4)cc3c3ccccc3c2n1.Cc1cnc2c3ccccc3c3cc(-c4cccc(-c5ccc6oc7ccccc7c6c5)c4)ccc3c2n1
• InChI: InChI=1S/C37H26N2O.2C35H22N2O/c1-21-16-22(2)36-32(17-21)33-20-25(18-23(3)37(33)40-36)27-9-5-4-8-26(27)24-12-13-30-31(19-24)28-10-6-7-11-29(28)34-35(30)39-15-14-38-34;1-21-20-36-34-29-15-13-24(18-30(29)26-9-2-3-11-28(26)35(34)37-21)22-7-6-8-23(17-22)25-14-16-33-31(19-25)27-10-4-5-12-32(27)38-33;1-21-20-36-34-28-11-3-2-9-26(28)30-18-24(13-15-29(30)35(34)37-21)22-7-6-8-23(17-22)25-14-16-33-31(19-25)27-10-4-5-12-32(27)38-33/h4-20H,1-3H3;2*2-20H,1H3
• InChIKey: GOYRMUNNOSQTHR-UHFFFAOYSA-N
• XLogP: 29.05
• TPSA: 116.76 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 6
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1487.78
LogP ≤ 5	29.05
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine?

The IUPAC name of 7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine (CID 158322002) is 7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine.

What is the SMILES notation for 7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine?

The canonical SMILES for 7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine is Cc1cc(C)c2oc3c(C)cc(-c4ccccc4-c4ccc5c(c4)c4ccccc4c4nccnc54)cc3c2c1.Cc1cnc2c3ccc(-c4cccc(-c5ccc6oc7ccccc7c6c5)c4)cc3c3ccccc3c2n1.Cc1cnc2c3ccccc3c3cc(-c4cccc(-c5ccc6oc7ccccc7c6c5)c4)ccc3c2n1.

What is the InChIKey of 7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine?

The InChIKey is GOYRMUNNOSQTHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H26N2O.2C35H22N2O/c1-21-16-22(2)36-32(17-21)33-20-25(18-23(3)37(33)40-36)27-9-5-4-8-26(27)24-12-13-30-31(19-24)28-10-6-7-11-29(28)34-35(30)39-15-14-38-34;1-21-20-36-34-29-15-13-24(18-30(29)26-9-2-3-11-28(26)35(34)37-21)22-7-6-8-23(17-22)25-14-16-33-31(19-25)27-10-4-5-12-32(27)38-33;1-21-20-36-34-28-11-3-2-9-26(28)30-18-24(13-15-29(30)35(34)37-21)22-7-6-8-23(17-22)25-14-16-33-31(19-25)27-10-4-5-12-32(27)38-33/h4-20H,1-3H3;2*2-20H,1H3.

What are the key properties of 7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine?

7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine has a molecular weight of 1487.78 g/mol, XLogP of 29.05, 6 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 7-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-(3-dibenzofuran-2-ylphenyl)-3-methylphenanthro[9,10-b]pyrazine;10-[2-(4,6,8-trimethyldibenzofuran-2-yl)phenyl]phenanthro[9,10-b]pyrazine is sourced from PubChem (CID 158322002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).