N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline

C82H80N2Si4 — CID 59194308

IUPACN,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline
SMILESC[Si](C)(C)c1ccc(N(c2ccc(-c3c4ccccc4c(-c4cccc(-c5c6ccccc6c(-c6ccc(N(c7ccc([Si](C)(C)C)cc7)c7ccc([Si](C)(C)C)cc7)cc6)c6ccccc56)c4)c4ccccc34)cc2)c2ccc([Si](C)(C)C)cc2)cc1
InChIInChI=1S/C82H80N2Si4/c1-85(2,3)67-48-40-63(41-49-67)83(64-42-50-68(51-43-64)86(4,5)6)61-36-32-57(33-37-61)79-71-24-13-17-28-75(71)81(76-29-18-14-25-72(76)79)59-22-21-23-60(56-59)82-77-30-19-15-26-73(77)80(74-27-16-20-31-78(74)82)58-34-38-62(39-35-58)84(65-44-52-69(53-45-65)87(7,8)9)66-46-54-70(55-47-66)88(10,11)12/h13-56H,1-12H3
InChIKeyCNEJQNYTDGSMKB-UHFFFAOYSA-N
MW1205.90 g/mol
LogP22.09
Rot. Bonds14

About N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline

N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline (PubChem CID 59194308) has the molecular formula C82H80N2Si4 and a molecular weight of 1205.90 g/mol. Its IUPAC name is N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline.

Molecular Properties

Compound NameN,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline
PubChem CID59194308
Molecular FormulaC82H80N2Si4
Molecular Weight1205.90 g/mol
Exact Mass1204.54
IUPAC NameN,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline
SMILESC[Si](C)(C)c1ccc(N(c2ccc(-c3c4ccccc4c(-c4cccc(-c5c6ccccc6c(-c6ccc(N(c7ccc([Si](C)(C)C)cc7)c7ccc([Si](C)(C)C)cc7)cc6)c6ccccc56)c4)c4ccccc34)cc2)c2ccc([Si](C)(C)C)cc2)cc1
InChIInChI=1S/C82H80N2Si4/c1-85(2,3)67-48-40-63(41-49-67)83(64-42-50-68(51-43-64)86(4,5)6)61-36-32-57(33-37-61)79-71-24-13-17-28-75(71)81(76-29-18-14-25-72(76)79)59-22-21-23-60(56-59)82-77-30-19-15-26-73(77)80(74-27-16-20-31-78(74)82)58-34-38-62(39-35-58)84(65-44-52-69(53-45-65)87(7,8)9)66-46-54-70(55-47-66)88(10,11)12/h13-56H,1-12H3
InChIKeyCNEJQNYTDGSMKB-UHFFFAOYSA-N
XLogP22.09
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms88
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001205.90
LogP ≤ 522.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline with MolForge

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

Launch Full Analysis

Related Compounds

[4-[10-[3,5-bis[10-(4-trimethylsilylphenyl)anthracen-9-yl]phenyl]anthracen-9-yl]phenyl]-trimethylsilane
CID 58722457
trimethyl-[4-[4-(10-phenylanthracen-9-yl)phenyl]phenyl]silane
CID 157160990
N-[4-[10-[3-[10-(4-methylphenyl)anthracen-9-yl]phenyl]anthracen-9-yl]phenyl]-N,4-diphenylaniline;1-methyl-4-phenylbenzene;toluene
CID 143567044
N,N-diphenyl-4-[4-[4-(N-(4-trimethylsilylphenyl)anilino)phenyl]phenyl]aniline;N,4-diphenyl-N-[4-[4-[4-(N-(4-trimethylsilylphenyl)anilino)phenyl]phenyl]phenyl]aniline;4-phenyl-N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]-N-(4-trimethylsilylphenyl)aniline
CID 165073252
N-phenyl-N-[4-[4-[4-(N-(4-phenylphenyl)anilino)phenyl]phenyl]phenyl]-3-(4-trimethylsilylphenyl)aniline
CID 165066954
9,10-bis(4-phenylphenyl)-2-N,2-N,6-N,6-N-tetrakis(4-trimethylsilylphenyl)anthracene-2,6-diamine;2-N,2-N,6-N,6-N-tetrakis(3,5-dimethylphenyl)-9,10-bis(4-phenylphenyl)anthracene-2,6-diamine;2-N,2-N,6-N,6-N-tetrakis(4-methylphenyl)-9,10-bis(4-phenylphenyl)anthracene-2,6-diamine
CID 159618681
2-N,6-N-diphenyl-9,10-bis[3-(2-phenylethenyl)phenyl]-2-N,6-N-bis(4-trimethylsilylphenyl)anthracene-2,6-diamine
CID 76628816
trimethyl-[4-[10-[4-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]phenyl]anthracen-9-yl]phenyl]silane
CID 59024575
4-[10-[3-[10-(4-methylphenyl)anthracen-9-yl]phenyl]anthracen-9-yl]-N,N-bis(4-trimethylgermylphenyl)aniline
CID 143567000
4-[3-[10-(3-methylphenyl)anthracen-9-yl]phenyl]-N,N-diphenylaniline
CID 142004488
1-N-phenyl-1-N-[4-(10-phenylanthracen-9-yl)phenyl]-4-N,4-N-bis(4-phenylphenyl)benzene-1,4-diamine
CID 59221806
1-N-phenyl-1-N-[4-(10-phenylanthracen-9-yl)phenyl]-4-N,4-N-bis(3-phenylphenyl)benzene-1,4-diamine
CID 59221815

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline?
The IUPAC name of N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline (CID 59194308) is N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline.
What is the SMILES notation for N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline?
The canonical SMILES for N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline is C[Si](C)(C)c1ccc(N(c2ccc(-c3c4ccccc4c(-c4cccc(-c5c6ccccc6c(-c6ccc(N(c7ccc([Si](C)(C)C)cc7)c7ccc([Si](C)(C)C)cc7)cc6)c6ccccc56)c4)c4ccccc34)cc2)c2ccc([Si](C)(C)C)cc2)cc1.
What is the InChIKey of N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline?
The InChIKey is CNEJQNYTDGSMKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C82H80N2Si4/c1-85(2,3)67-48-40-63(41-49-67)83(64-42-50-68(51-43-64)86(4,5)6)61-36-32-57(33-37-61)79-71-24-13-17-28-75(71)81(76-29-18-14-25-72(76)79)59-22-21-23-60(56-59)82-77-30-19-15-26-73(77)80(74-27-16-20-31-78(74)82)58-34-38-62(39-35-58)84(65-44-52-69(53-45-65)87(7,8)9)66-46-54-70(55-47-66)88(10,11)12/h13-56H,1-12H3.
What are the key properties of N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline?
N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline has a molecular weight of 1205.90 g/mol, XLogP of 22.09, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-trimethylsilylphenyl)-4-[10-[3-[10-[4-(4-trimethylsilyl-N-(4-trimethylsilylphenyl)anilino)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]aniline is sourced from PubChem (CID 59194308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).