4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine

C145H101NO6 — CID 149095960

About 4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine

4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine (PubChem CID 149095960) has the molecular formula C145H101NO6 and a molecular weight of 1953.40 g/mol. Its IUPAC name is 4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine.

Molecular Properties

• Compound Name: 4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine
• PubChem CID: 149095960
• Molecular Formula: C145H101NO6
• Molecular Weight: 1953.40 g/mol
• Exact Mass: 1951.76
• IUPAC Name: 4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine
• SMILES: c1ccc(-c2c3ccccc3c(-c3ccc(COc4cc(COc5ccc(-c6cccc(-c7cc(-c8ccc(OCc9cc(OCc%10ccc(-c%11c%12ccccc%12c(-c%12ccccc%12)c%12ccccc%11%12)cc%10)cc(OCc%10ccc(-c%11c%12ccccc%12c(-c%12ccccc%12)c%12ccccc%11%12)cc%10)c9)cc8)ccn7)c6)cc5)cc(OCc5ccc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)cc5)c4)cc3)c3ccccc23)cc1
• InChI: InChI=1S/C145H101NO6/c1-5-30-104(31-6-1)138-121-40-13-21-48-129(121)142(130-49-22-14-41-122(130)138)108-64-56-96(57-65-108)90-149-117-82-100(83-118(88-117)150-91-97-58-66-109(67-59-97)143-131-50-23-15-42-123(131)139(105-32-7-2-8-33-105)124-43-16-24-51-132(124)143)94-147-115-76-72-102(73-77-115)112-38-29-39-114(86-112)137-87-113(80-81-146-137)103-74-78-116(79-75-103)148-95-101-84-119(151-92-98-60-68-110(69-61-98)144-133-52-25-17-44-125(133)140(106-34-9-3-10-35-106)126-45-18-26-53-134(126)144)89-120(85-101)152-93-99-62-70-111(71-63-99)145-135-54-27-19-46-127(135)141(107-36-11-4-12-37-107)128-47-20-28-55-136(128)145/h1-89H,90-95H2
• InChIKey: JHKWDHAPAYAGAF-UHFFFAOYSA-N
• XLogP: 38.12
• TPSA: 68.27 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 29
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1953.40
LogP ≤ 5	38.12
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine?

The IUPAC name of 4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine (CID 149095960) is 4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine.

What is the SMILES notation for 4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine?

The canonical SMILES for 4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine is c1ccc(-c2c3ccccc3c(-c3ccc(COc4cc(COc5ccc(-c6cccc(-c7cc(-c8ccc(OCc9cc(OCc%10ccc(-c%11c%12ccccc%12c(-c%12ccccc%12)c%12ccccc%11%12)cc%10)cc(OCc%10ccc(-c%11c%12ccccc%12c(-c%12ccccc%12)c%12ccccc%11%12)cc%10)c9)cc8)ccn7)c6)cc5)cc(OCc5ccc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)cc5)c4)cc3)c3ccccc23)cc1.

What is the InChIKey of 4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine?

The InChIKey is JHKWDHAPAYAGAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C145H101NO6/c1-5-30-104(31-6-1)138-121-40-13-21-48-129(121)142(130-49-22-14-41-122(130)138)108-64-56-96(57-65-108)90-149-117-82-100(83-118(88-117)150-91-97-58-66-109(67-59-97)143-131-50-23-15-42-123(131)139(105-32-7-2-8-33-105)124-43-16-24-51-132(124)143)94-147-115-76-72-102(73-77-115)112-38-29-39-114(86-112)137-87-113(80-81-146-137)103-74-78-116(79-75-103)148-95-101-84-119(151-92-98-60-68-110(69-61-98)144-133-52-25-17-44-125(133)140(106-34-9-3-10-35-106)126-45-18-26-53-134(126)144)89-120(85-101)152-93-99-62-70-111(71-63-99)145-135-54-27-19-46-127(135)141(107-36-11-4-12-37-107)128-47-20-28-55-136(128)145/h1-89H,90-95H2.

What are the key properties of 4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine?

4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine has a molecular weight of 1953.40 g/mol, XLogP of 38.12, 29 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]-2-[3-[4-[[3,5-bis[[4-(10-phenylanthracen-9-yl)phenyl]methoxy]phenyl]methoxy]phenyl]phenyl]pyridine is sourced from PubChem (CID 149095960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).