9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine

C139H88F10N4O2 — CID 172547078

About 9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine

9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine (PubChem CID 172547078) has the molecular formula C139H88F10N4O2 and a molecular weight of 2036.24 g/mol. Its IUPAC name is 9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine.

Molecular Properties

• Compound Name: 9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine
• PubChem CID: 172547078
• Molecular Formula: C139H88F10N4O2
• Molecular Weight: 2036.24 g/mol
• Exact Mass: 2034.67
• IUPAC Name: 9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine
• SMILES: C=Cc1ccc(Oc2ccc(C3(c4cc(F)c(F)cc4F)c4ccccc4-c4ccc(N(c5ccc(F)cc5)c5ccc(-c6ccc(N(c7ccc(F)cc7)c7ccc(C8(c9ccc(N(c%10ccc(F)cc%10)c%10ccc(-c%11ccc(N(c%12ccc(F)cc%12)c%12ccc%13c(c%12)C(c%12ccc(Oc%14ccc(C=C)cc%14)cc%12)(c%12cc(F)c(F)cc%12F)c%12ccccc%12-%13)cc%11)cc%10)cc9)c9ccccc9-c9ccccc98)cc7)cc6)cc5)cc43)cc2)cc1
• InChI: InChI=1S/C139H88F10N4O2/c1-3-87-21-71-113(72-22-87)154-115-75-37-95(38-76-115)138(129-83-133(146)135(148)85-131(129)144)125-19-11-7-15-119(125)121-79-69-111(81-127(121)138)152(109-65-45-99(142)46-66-109)103-53-29-91(30-54-103)89-25-49-101(50-26-89)150(107-61-41-97(140)42-62-107)105-57-33-93(34-58-105)137(123-17-9-5-13-117(123)118-14-6-10-18-124(118)137)94-35-59-106(60-36-94)151(108-63-43-98(141)44-64-108)102-51-27-90(28-52-102)92-31-55-104(56-32-92)153(110-67-47-100(143)48-68-110)112-70-80-122-120-16-8-12-20-126(120)139(128(122)82-112,130-84-134(147)136(149)86-132(130)145)96-39-77-116(78-40-96)155-114-73-23-88(4-2)24-74-114/h3-86H,1-2H2
• InChIKey: DCRMDUHKULQFQU-UHFFFAOYSA-N
• XLogP: 38.25
• TPSA: 31.42 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 26
• Heavy Atoms: 155
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2036.24
LogP ≤ 5	38.25
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine?

The IUPAC name of 9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine (CID 172547078) is 9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine.

What is the SMILES notation for 9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine?

The canonical SMILES for 9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine is C=Cc1ccc(Oc2ccc(C3(c4cc(F)c(F)cc4F)c4ccccc4-c4ccc(N(c5ccc(F)cc5)c5ccc(-c6ccc(N(c7ccc(F)cc7)c7ccc(C8(c9ccc(N(c%10ccc(F)cc%10)c%10ccc(-c%11ccc(N(c%12ccc(F)cc%12)c%12ccc%13c(c%12)C(c%12ccc(Oc%14ccc(C=C)cc%14)cc%12)(c%12cc(F)c(F)cc%12F)c%12ccccc%12-%13)cc%11)cc%10)cc9)c9ccccc9-c9ccccc98)cc7)cc6)cc5)cc43)cc2)cc1.

What is the InChIKey of 9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine?

The InChIKey is DCRMDUHKULQFQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C139H88F10N4O2/c1-3-87-21-71-113(72-22-87)154-115-75-37-95(38-76-115)138(129-83-133(146)135(148)85-131(129)144)125-19-11-7-15-119(125)121-79-69-111(81-127(121)138)152(109-65-45-99(142)46-66-109)103-53-29-91(30-54-103)89-25-49-101(50-26-89)150(107-61-41-97(140)42-62-107)105-57-33-93(34-58-105)137(123-17-9-5-13-117(123)118-14-6-10-18-124(118)137)94-35-59-106(60-36-94)151(108-63-43-98(141)44-64-108)102-51-27-90(28-52-102)92-31-55-104(56-32-92)153(110-67-47-100(143)48-68-110)112-70-80-122-120-16-8-12-20-126(120)139(128(122)82-112,130-84-134(147)136(149)86-132(130)145)96-39-77-116(78-40-96)155-114-73-23-88(4-2)24-74-114/h3-86H,1-2H2.

What are the key properties of 9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine?

9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine has a molecular weight of 2036.24 g/mol, XLogP of 38.25, 26 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[9-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,4,5-trifluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]-N-(4-fluorophenyl)-9-(2,4,5-trifluorophenyl)fluoren-2-amine is sourced from PubChem (CID 172547078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).