7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine

C102H72N2O2 — CID 139469393

IUPAC7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine
SMILESCC1(C)c2cc(-c3ccc(-c4ccccc4)cc3)ccc2-c2ccc(N(c3ccc4oc5cc(-c6ccc(-c7ccccc7)c(N(c7ccc8c(c7)C(C)(C)c7cc(-c9ccc(-c%10ccccc%10)cc9)ccc7-8)c7cccc8c7oc7ccccc78)c6)ccc5c4c3)c3ccccc3-c3ccccc3)cc21
InChIInChI=1S/C102H72N2O2/c1-101(2)90-58-73(69-40-36-67(37-41-69)65-22-9-5-10-23-65)45-52-82(90)84-55-48-78(63-92(84)101)103(94-33-19-17-30-80(94)71-26-13-7-14-27-71)77-50-57-98-89(62-77)87-54-47-76(61-99(87)105-98)75-44-51-81(72-28-15-8-16-29-72)96(60-75)104(95-34-21-32-88-86-31-18-20-35-97(86)106-100(88)95)79-49-56-85-83-53-46-74(59-91(83)102(3,4)93(85)64-79)70-42-38-68(39-43-70)66-24-11-6-12-25-66/h5-64H,1-4H3
InChIKeyDTRQLWJMBCDLDY-UHFFFAOYSA-N
MW1357.71 g/mol
LogP28.71
Rot. Bonds13

About 7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine

7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine (PubChem CID 139469393) has the molecular formula C102H72N2O2 and a molecular weight of 1357.71 g/mol. Its IUPAC name is 7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine.

Molecular Properties

Compound Name7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine
PubChem CID139469393
Molecular FormulaC102H72N2O2
Molecular Weight1357.71 g/mol
Exact Mass1356.56
IUPAC Name7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine
SMILESCC1(C)c2cc(-c3ccc(-c4ccccc4)cc3)ccc2-c2ccc(N(c3ccc4oc5cc(-c6ccc(-c7ccccc7)c(N(c7ccc8c(c7)C(C)(C)c7cc(-c9ccc(-c%10ccccc%10)cc9)ccc7-8)c7cccc8c7oc7ccccc78)c6)ccc5c4c3)c3ccccc3-c3ccccc3)cc21
InChIInChI=1S/C102H72N2O2/c1-101(2)90-58-73(69-40-36-67(37-41-69)65-22-9-5-10-23-65)45-52-82(90)84-55-48-78(63-92(84)101)103(94-33-19-17-30-80(94)71-26-13-7-14-27-71)77-50-57-98-89(62-77)87-54-47-76(61-99(87)105-98)75-44-51-81(72-28-15-8-16-29-72)96(60-75)104(95-34-21-32-88-86-31-18-20-35-97(86)106-100(88)95)79-49-56-85-83-53-46-74(59-91(83)102(3,4)93(85)64-79)70-42-38-68(39-43-70)66-24-11-6-12-25-66/h5-64H,1-4H3
InChIKeyDTRQLWJMBCDLDY-UHFFFAOYSA-N
XLogP28.71
TPSA32.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms106
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001357.71
LogP ≤ 528.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine?
The IUPAC name of 7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine (CID 139469393) is 7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine.
What is the SMILES notation for 7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine?
The canonical SMILES for 7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine is CC1(C)c2cc(-c3ccc(-c4ccccc4)cc3)ccc2-c2ccc(N(c3ccc4oc5cc(-c6ccc(-c7ccccc7)c(N(c7ccc8c(c7)C(C)(C)c7cc(-c9ccc(-c%10ccccc%10)cc9)ccc7-8)c7cccc8c7oc7ccccc78)c6)ccc5c4c3)c3ccccc3-c3ccccc3)cc21.
What is the InChIKey of 7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine?
The InChIKey is DTRQLWJMBCDLDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C102H72N2O2/c1-101(2)90-58-73(69-40-36-67(37-41-69)65-22-9-5-10-23-65)45-52-82(90)84-55-48-78(63-92(84)101)103(94-33-19-17-30-80(94)71-26-13-7-14-27-71)77-50-57-98-89(62-77)87-54-47-76(61-99(87)105-98)75-44-51-81(72-28-15-8-16-29-72)96(60-75)104(95-34-21-32-88-86-31-18-20-35-97(86)106-100(88)95)79-49-56-85-83-53-46-74(59-91(83)102(3,4)93(85)64-79)70-42-38-68(39-43-70)66-24-11-6-12-25-66/h5-64H,1-4H3.
What are the key properties of 7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine?
7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine has a molecular weight of 1357.71 g/mol, XLogP of 28.71, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[3-[dibenzofuran-4-yl-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]amino]-4-phenylphenyl]-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(2-phenylphenyl)dibenzofuran-2-amine is sourced from PubChem (CID 139469393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).