4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine

C120H80N4O3 — CID 155120194

About 4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine

4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine (PubChem CID 155120194) has the molecular formula C120H80N4O3 and a molecular weight of 1625.98 g/mol. Its IUPAC name is 4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine.

Molecular Properties

• Compound Name: 4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine
• PubChem CID: 155120194
• Molecular Formula: C120H80N4O3
• Molecular Weight: 1625.98 g/mol
• Exact Mass: 1624.62
• IUPAC Name: 4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine
• SMILES: CC1(C)c2ccccc2-c2c(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3cccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6cccc(-c7ccc(N(c8ccc(-c9ccccc9)cc8)c8cccc9c8-c8ccccc8C9(C)C)c8c7oc7ccc(-c9cccc%10c%11ccccc%11n(-c%11ccccc%11)c9%10)cc78)c6)cc5c34)cccc21
• InChI: InChI=1S/C120H80N4O3/c1-119(2)97-42-16-11-36-92(97)112-99(119)44-24-48-104(112)121(82-62-55-75(56-63-82)85-39-23-41-91-89-35-15-20-51-108(89)126-117(85)91)106-50-26-52-111-114(106)95-71-77(58-67-109(95)125-111)76-57-65-103-94(70-76)88-34-14-18-46-101(88)123(103)83-32-21-29-78(69-83)86-64-66-107(122(81-60-53-74(54-61-81)73-27-7-5-8-28-73)105-49-25-45-100-113(105)93-37-12-17-43-98(93)120(100,3)4)115-96-72-79(59-68-110(96)127-118(86)115)84-38-22-40-90-87-33-13-19-47-102(87)124(116(84)90)80-30-9-6-10-31-80/h5-72H,1-4H3
• InChIKey: ADHSBGAWMHRDAS-UHFFFAOYSA-N
• XLogP: 33.47
• TPSA: 55.76 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 13
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1625.98
LogP ≤ 5	33.47
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine?

The IUPAC name of 4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine (CID 155120194) is 4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine.

What is the SMILES notation for 4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine?

The canonical SMILES for 4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine is CC1(C)c2ccccc2-c2c(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3cccc4oc5ccc(-c6ccc7c(c6)c6ccccc6n7-c6cccc(-c7ccc(N(c8ccc(-c9ccccc9)cc8)c8cccc9c8-c8ccccc8C9(C)C)c8c7oc7ccc(-c9cccc%10c%11ccccc%11n(-c%11ccccc%11)c9%10)cc78)c6)cc5c34)cccc21.

What is the InChIKey of 4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine?

The InChIKey is ADHSBGAWMHRDAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C120H80N4O3/c1-119(2)97-42-16-11-36-92(97)112-99(119)44-24-48-104(112)121(82-62-55-75(56-63-82)85-39-23-41-91-89-35-15-20-51-108(89)126-117(85)91)106-50-26-52-111-114(106)95-71-77(58-67-109(95)125-111)76-57-65-103-94(70-76)88-34-14-18-46-101(88)123(103)83-32-21-29-78(69-83)86-64-66-107(122(81-60-53-74(54-61-81)73-27-7-5-8-28-73)105-49-25-45-100-113(105)93-37-12-17-43-98(93)120(100,3)4)115-96-72-79(59-68-110(96)127-118(86)115)84-38-22-40-90-87-33-13-19-47-102(87)124(116(84)90)80-30-9-6-10-31-80/h5-72H,1-4H3.

What are the key properties of 4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine?

4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine has a molecular weight of 1625.98 g/mol, XLogP of 33.47, 13 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[3-[3-[9-(4-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-4-yl)anilino)dibenzofuran-2-yl]carbazol-9-yl]phenyl]-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine is sourced from PubChem (CID 155120194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).