11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole

C88H54N10O2 — CID 163428681

About 11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole

11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole (PubChem CID 163428681) has the molecular formula C88H54N10O2 and a molecular weight of 1283.47 g/mol. Its IUPAC name is 11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole.

Molecular Properties

• Compound Name: 11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole
• PubChem CID: 163428681
• Molecular Formula: C88H54N10O2
• Molecular Weight: 1283.47 g/mol
• Exact Mass: 1282.44
• IUPAC Name: 11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole
• SMILES: c1ccc(-c2ccc(-c3nc(-c4cccnc4)nc(-c4cccc5c4oc4cc6c7ccccc7n(-c7ccccc7)c6cc45)n3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccccn4)nc(-c4cccc5c4oc4cc6c7ccccc7n(-c7ccccc7)c6cc45)n3)c2)cc1
• InChI: InChI=1S/2C44H27N5O/c1-3-11-28(12-4-1)29-20-22-30(23-21-29)42-46-43(31-13-10-24-45-27-31)48-44(47-42)35-18-9-17-34-37-25-39-36(26-40(37)50-41(34)35)33-16-7-8-19-38(33)49(39)32-14-5-2-6-15-32;1-3-13-28(14-4-1)29-15-11-16-30(25-29)42-46-43(48-44(47-42)37-22-9-10-24-45-37)34-21-12-20-33-36-26-39-35(27-40(36)50-41(33)34)32-19-7-8-23-38(32)49(39)31-17-5-2-6-18-31/h2*1-27H
• InChIKey: AOQOBKFNHJSNBG-UHFFFAOYSA-N
• XLogP: 21.86
• TPSA: 139.26 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 10
• Heavy Atoms: 100
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1283.47
LogP ≤ 5	21.86
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole?

The IUPAC name of 11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole (CID 163428681) is 11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole.

What is the SMILES notation for 11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole?

The canonical SMILES for 11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole is c1ccc(-c2ccc(-c3nc(-c4cccnc4)nc(-c4cccc5c4oc4cc6c7ccccc7n(-c7ccccc7)c6cc45)n3)cc2)cc1.c1ccc(-c2cccc(-c3nc(-c4ccccn4)nc(-c4cccc5c4oc4cc6c7ccccc7n(-c7ccccc7)c6cc45)n3)c2)cc1.

What is the InChIKey of 11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole?

The InChIKey is AOQOBKFNHJSNBG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C44H27N5O/c1-3-11-28(12-4-1)29-20-22-30(23-21-29)42-46-43(31-13-10-24-45-27-31)48-44(47-42)35-18-9-17-34-37-25-39-36(26-40(37)50-41(34)35)33-16-7-8-19-38(33)49(39)32-14-5-2-6-15-32;1-3-13-28(14-4-1)29-15-11-16-30(25-29)42-46-43(48-44(47-42)37-22-9-10-24-45-37)34-21-12-20-33-36-26-39-35(27-40(36)50-41(33)34)32-19-7-8-23-38(32)49(39)31-17-5-2-6-18-31/h2*1-27H.

What are the key properties of 11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole?

11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole has a molecular weight of 1283.47 g/mol, XLogP of 21.86, 10 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 11-phenyl-4-[4-(3-phenylphenyl)-6-pyridin-2-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole;11-phenyl-4-[4-(4-phenylphenyl)-6-pyridin-3-yl-1,3,5-triazin-2-yl]-[1]benzofuro[3,2-b]carbazole is sourced from PubChem (CID 163428681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).