10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine

C60H41N3 — CID 143250787

About 10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine

10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine (PubChem CID 143250787) has the molecular formula C60H41N3 and a molecular weight of 804.01 g/mol. Its IUPAC name is 10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine.

Molecular Properties

• Compound Name: 10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine
• PubChem CID: 143250787
• Molecular Formula: C60H41N3
• Molecular Weight: 804.01 g/mol
• Exact Mass: 803.33
• IUPAC Name: 10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine
• SMILES: c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4cccc(-c5cc(N6c7ccccc7Cc7ccccc76)ccc5-n5c6ccccc6c6ccccc65)c4)c3)cc2)cc1
• InChI: InChI=1S/C60H41N3/c1-3-16-41(17-4-1)42-30-32-43(33-31-42)49-38-54(44-18-5-2-6-19-44)61-55(39-49)46-23-15-22-45(36-46)53-40-50(62-56-26-11-7-20-47(56)37-48-21-8-12-27-57(48)62)34-35-60(53)63-58-28-13-9-24-51(58)52-25-10-14-29-59(52)63/h1-36,38-40H,37H2
• InChIKey: RXFGEWMLVQSPQO-UHFFFAOYSA-N
• XLogP: 15.89
• TPSA: 21.06 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 7
• Heavy Atoms: 63
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	804.01
LogP ≤ 5	15.89
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine?

The IUPAC name of 10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine (CID 143250787) is 10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine.

What is the SMILES notation for 10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine?

The canonical SMILES for 10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine is c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4cccc(-c5cc(N6c7ccccc7Cc7ccccc76)ccc5-n5c6ccccc6c6ccccc65)c4)c3)cc2)cc1.

What is the InChIKey of 10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine?

The InChIKey is RXFGEWMLVQSPQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H41N3/c1-3-16-41(17-4-1)42-30-32-43(33-31-42)49-38-54(44-18-5-2-6-19-44)61-55(39-49)46-23-15-22-45(36-46)53-40-50(62-56-26-11-7-20-47(56)37-48-21-8-12-27-57(48)62)34-35-60(53)63-58-28-13-9-24-51(58)52-25-10-14-29-59(52)63/h1-36,38-40H,37H2.

What are the key properties of 10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine?

10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine has a molecular weight of 804.01 g/mol, XLogP of 15.89, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 10-[4-carbazol-9-yl-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]-9H-acridine is sourced from PubChem (CID 143250787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).