7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole

C102H65N11 — CID 165109992

About 7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole

7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole (PubChem CID 165109992) has the molecular formula C102H65N11 and a molecular weight of 1444.72 g/mol. Its IUPAC name is 7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole.

Molecular Properties

• Compound Name: 7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole
• PubChem CID: 165109992
• Molecular Formula: C102H65N11
• Molecular Weight: 1444.72 g/mol
• Exact Mass: 1443.54
• IUPAC Name: 7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole
• SMILES: c1ccc(-c2cc(-c3ccc(-c4ccc5ccc(-c6ccc7ccc(-c8ccccn8)nc7c6)nc5c4)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-c4ccc5ccc(-c6ccc7ccc(-c8ccccn8)nc7c6)nc5c4)cc3)cc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1
• InChI: InChI=1S/C57H36N6.C45H29N5/c1-2-11-41(12-3-1)57-61-53(36-54(62-57)43-13-10-14-45(33-43)63-55-18-6-4-15-46(55)47-16-5-7-19-56(47)63)38-22-20-37(21-23-38)42-26-24-39-28-30-48(59-51(39)34-42)44-27-25-40-29-31-50(60-52(40)35-44)49-17-8-9-32-58-49;1-3-9-31(10-4-1)43-29-44(50-45(49-43)35-11-5-2-6-12-35)32-16-14-30(15-17-32)36-20-18-33-22-24-38(47-41(33)27-36)37-21-19-34-23-25-40(48-42(34)28-37)39-13-7-8-26-46-39/h1-36H;1-29H
• InChIKey: ZUASXXSAPJLRFB-UHFFFAOYSA-N
• XLogP: 25.04
• TPSA: 133.83 Ų
• H-Bond Acceptors: 11
• Rotatable Bonds: 13
• Heavy Atoms: 113
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1444.72
LogP ≤ 5	25.04
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	11

Frequently Asked Questions

What is the IUPAC name of 7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole?

The IUPAC name of 7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole (CID 165109992) is 7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole.

What is the SMILES notation for 7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole?

The canonical SMILES for 7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole is c1ccc(-c2cc(-c3ccc(-c4ccc5ccc(-c6ccc7ccc(-c8ccccn8)nc7c6)nc5c4)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccc(-c4ccc5ccc(-c6ccc7ccc(-c8ccccn8)nc7c6)nc5c4)cc3)cc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)n2)cc1.

What is the InChIKey of 7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole?

The InChIKey is ZUASXXSAPJLRFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H36N6.C45H29N5/c1-2-11-41(12-3-1)57-61-53(36-54(62-57)43-13-10-14-45(33-43)63-55-18-6-4-15-46(55)47-16-5-7-19-56(47)63)38-22-20-37(21-23-38)42-26-24-39-28-30-48(59-51(39)34-42)44-27-25-40-29-31-50(60-52(40)35-44)49-17-8-9-32-58-49;1-3-9-31(10-4-1)43-29-44(50-45(49-43)35-11-5-2-6-12-35)32-16-14-30(15-17-32)36-20-18-33-22-24-38(47-41(33)27-36)37-21-19-34-23-25-40(48-42(34)28-37)39-13-7-8-26-46-39/h1-36H;1-29H.

What are the key properties of 7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole?

7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole has a molecular weight of 1444.72 g/mol, XLogP of 25.04, 13 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-(2-pyridin-2-ylquinolin-7-yl)quinoline;9-[3-[2-phenyl-6-[4-[2-(2-pyridin-2-ylquinolin-7-yl)quinolin-7-yl]phenyl]pyrimidin-4-yl]phenyl]carbazole is sourced from PubChem (CID 165109992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).