9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine

C84H59F2N3OSi2 — CID 59381381

IUPAC9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine
SMILESFc1ccc(-n2c3ccc(N(c4ccc(Oc5ccccc5)cc4)c4ccc5c(c4)c4cc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)ccc4n5-c4ccc(F)cc4)cc3c3cc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc32)cc1
InChIInChI=1S/C84H59F2N3OSi2/c85-60-36-40-63(41-37-60)88-81-52-46-65(56-77(81)79-58-75(50-54-83(79)88)91(69-24-10-2-11-25-69,70-26-12-3-13-27-70)71-28-14-4-15-29-71)87(62-44-48-68(49-45-62)90-67-22-8-1-9-23-67)66-47-53-82-78(57-66)80-59-76(51-55-84(80)89(82)64-42-38-61(86)39-43-64)92(72-30-16-5-17-31-72,73-32-18-6-19-33-73)74-34-20-7-21-35-74/h1-59H
InChIKeyBIRANJYXUQFPRF-UHFFFAOYSA-N
MW1220.58 g/mol
LogP16.18
Rot. Bonds15

About 9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine

9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine (PubChem CID 59381381) has the molecular formula C84H59F2N3OSi2 and a molecular weight of 1220.58 g/mol. Its IUPAC name is 9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine.

Molecular Properties

Compound Name9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine
PubChem CID59381381
Molecular FormulaC84H59F2N3OSi2
Molecular Weight1220.58 g/mol
Exact Mass1219.42
IUPAC Name9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine
SMILESFc1ccc(-n2c3ccc(N(c4ccc(Oc5ccccc5)cc4)c4ccc5c(c4)c4cc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)ccc4n5-c4ccc(F)cc4)cc3c3cc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc32)cc1
InChIInChI=1S/C84H59F2N3OSi2/c85-60-36-40-63(41-37-60)88-81-52-46-65(56-77(81)79-58-75(50-54-83(79)88)91(69-24-10-2-11-25-69,70-26-12-3-13-27-70)71-28-14-4-15-29-71)87(62-44-48-68(49-45-62)90-67-22-8-1-9-23-67)66-47-53-82-78(57-66)80-59-76(51-55-84(80)89(82)64-42-38-61(86)39-43-64)92(72-30-16-5-17-31-72,73-32-18-6-19-33-73)74-34-20-7-21-35-74/h1-59H
InChIKeyBIRANJYXUQFPRF-UHFFFAOYSA-N
XLogP16.18
TPSA22.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms92
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001220.58
LogP ≤ 516.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine?
The IUPAC name of 9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine (CID 59381381) is 9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine.
What is the SMILES notation for 9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine?
The canonical SMILES for 9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine is Fc1ccc(-n2c3ccc(N(c4ccc(Oc5ccccc5)cc4)c4ccc5c(c4)c4cc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)ccc4n5-c4ccc(F)cc4)cc3c3cc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc32)cc1.
What is the InChIKey of 9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine?
The InChIKey is BIRANJYXUQFPRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H59F2N3OSi2/c85-60-36-40-63(41-37-60)88-81-52-46-65(56-77(81)79-58-75(50-54-83(79)88)91(69-24-10-2-11-25-69,70-26-12-3-13-27-70)71-28-14-4-15-29-71)87(62-44-48-68(49-45-62)90-67-22-8-1-9-23-67)66-47-53-82-78(57-66)80-59-76(51-55-84(80)89(82)64-42-38-61(86)39-43-64)92(72-30-16-5-17-31-72,73-32-18-6-19-33-73)74-34-20-7-21-35-74/h1-59H.
What are the key properties of 9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine?
9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine has a molecular weight of 1220.58 g/mol, XLogP of 16.18, 15 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine is sourced from PubChem (CID 59381381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).