2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine

C120H74N6OS — CID 166852130

About 2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine

2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine (PubChem CID 166852130) has the molecular formula C120H74N6OS and a molecular weight of 1648.02 g/mol. Its IUPAC name is 2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine.

Molecular Properties

• Compound Name: 2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine
• PubChem CID: 166852130
• Molecular Formula: C120H74N6OS
• Molecular Weight: 1648.02 g/mol
• Exact Mass: 1646.56
• IUPAC Name: 2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine
• SMILES: c1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4ccccc4-c4cccc5oc6cc(C7(c8ccccc8)c8ccccc8-c8cc(-c9cccc(C%10(c%11ccc%12sc%13ccc(-c%14cccc(-c%15nc(-c%16ccccc%16)nc(-c%16ccc%17ccccc%17c%16)n%15)c%14)cc%13c%12c%11)c%11ccccc%11-c%11ccccc%11%10)c9)ccc87)ccc6c45)n3)cc2)cc1
• InChI: InChI=1S/C120H74N6OS/c1-5-27-75(28-6-1)78-53-56-80(57-54-78)114-123-116(87-38-23-35-82(67-87)76-29-7-2-8-30-76)126-118(125-114)99-47-16-15-43-94(99)98-48-26-52-108-112(98)100-63-61-93(74-109(100)127-108)119(90-40-11-4-12-41-90)106-51-22-19-46-97(106)101-71-85(59-64-107(101)119)84-37-25-42-91(70-84)120(104-49-20-17-44-95(104)96-45-18-21-50-105(96)120)92-62-66-111-103(73-92)102-72-86(60-65-110(102)128-111)83-36-24-39-88(69-83)115-121-113(79-32-9-3-10-33-79)122-117(124-115)89-58-55-77-31-13-14-34-81(77)68-89/h1-74H
• InChIKey: FQBGQJTYKXDWNO-UHFFFAOYSA-N
• XLogP: 30.54
• TPSA: 90.48 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 15
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1648.02
LogP ≤ 5	30.54
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine?

The IUPAC name of 2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine (CID 166852130) is 2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine.

What is the SMILES notation for 2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine?

The canonical SMILES for 2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine is c1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4ccccc4-c4cccc5oc6cc(C7(c8ccccc8)c8ccccc8-c8cc(-c9cccc(C%10(c%11ccc%12sc%13ccc(-c%14cccc(-c%15nc(-c%16ccccc%16)nc(-c%16ccc%17ccccc%17c%16)n%15)c%14)cc%13c%12c%11)c%11ccccc%11-c%11ccccc%11%10)c9)ccc87)ccc6c45)n3)cc2)cc1.

What is the InChIKey of 2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine?

The InChIKey is FQBGQJTYKXDWNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C120H74N6OS/c1-5-27-75(28-6-1)78-53-56-80(57-54-78)114-123-116(87-38-23-35-82(67-87)76-29-7-2-8-30-76)126-118(125-114)99-47-16-15-43-94(99)98-48-26-52-108-112(98)100-63-61-93(74-109(100)127-108)119(90-40-11-4-12-41-90)106-51-22-19-46-97(106)101-71-85(59-64-107(101)119)84-37-25-42-91(70-84)120(104-49-20-17-44-95(104)96-45-18-21-50-105(96)120)92-62-66-111-103(73-92)102-72-86(60-65-110(102)128-111)83-36-24-39-88(69-83)115-121-113(79-32-9-3-10-33-79)122-117(124-115)89-58-55-77-31-13-14-34-81(77)68-89/h1-74H.

What are the key properties of 2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine?

2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine has a molecular weight of 1648.02 g/mol, XLogP of 30.54, 15 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2-naphthalen-2-yl-4-phenyl-6-[3-[8-[9-[3-[9-phenyl-9-[9-[2-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-3-yl]fluoren-3-yl]phenyl]fluoren-9-yl]dibenzothiophen-2-yl]phenyl]-1,3,5-triazine is sourced from PubChem (CID 166852130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).