6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine

C76H56N4 — CID 155073664

IUPAC6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine
SMILESC=Cc1ccc(-c2ccc3c(c2)c2c(n3-c3ccccc3)CCC(N(c3ccccc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccc6c(c5)c5cc(-c7ccc(C=C)cc7)ccc5n6-c5ccccc5)cc4)cc3)=C2)cc1
InChIInChI=1S/C76H56N4/c1-3-53-25-29-57(30-26-53)59-37-45-73-69(49-59)71-51-67(43-47-75(71)79(73)63-21-13-7-14-22-63)77(61-17-9-5-10-18-61)65-39-33-55(34-40-65)56-35-41-66(42-36-56)78(62-19-11-6-12-20-62)68-44-48-76-72(52-68)70-50-60(58-31-27-54(4-2)28-32-58)38-46-74(70)80(76)64-23-15-8-16-24-64/h3-43,45-47,49-52H,1-2,44,48H2
InChIKeyMBBQZWLCUFKZIF-UHFFFAOYSA-N
MW1025.31 g/mol
LogP20.61
Rot. Bonds13

About 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine

6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine (PubChem CID 155073664) has the molecular formula C76H56N4 and a molecular weight of 1025.31 g/mol. Its IUPAC name is 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine.

Molecular Properties

Compound Name6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine
PubChem CID155073664
Molecular FormulaC76H56N4
Molecular Weight1025.31 g/mol
Exact Mass1024.45
IUPAC Name6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine
SMILESC=Cc1ccc(-c2ccc3c(c2)c2c(n3-c3ccccc3)CCC(N(c3ccccc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccc6c(c5)c5cc(-c7ccc(C=C)cc7)ccc5n6-c5ccccc5)cc4)cc3)=C2)cc1
InChIInChI=1S/C76H56N4/c1-3-53-25-29-57(30-26-53)59-37-45-73-69(49-59)71-51-67(43-47-75(71)79(73)63-21-13-7-14-22-63)77(61-17-9-5-10-18-61)65-39-33-55(34-40-65)56-35-41-66(42-36-56)78(62-19-11-6-12-20-62)68-44-48-76-72(52-68)70-50-60(58-31-27-54(4-2)28-32-58)38-46-74(70)80(76)64-23-15-8-16-24-64/h3-43,45-47,49-52H,1-2,44,48H2
InChIKeyMBBQZWLCUFKZIF-UHFFFAOYSA-N
XLogP20.61
TPSA16.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms80
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001025.31
LogP ≤ 520.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine with MolForge

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Related Compounds

6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenylcarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine
CID 139320793
N-[4-[9-(4-ethenylphenyl)-6-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 142340184
4-N-[4-[9-(4-ethenylphenyl)carbazol-3-yl]phenyl]-4-N-[4-[4-[4-[9-(4-ethenylphenyl)carbazol-3-yl]-N-[4-(N-phenylanilino)phenyl]anilino]phenyl]phenyl]-1-N,1-N-diphenylbenzene-1,4-diamine
CID 137428819
4-[4-(4-ethenylphenyl)phenyl]-N,N-bis[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 58568926
6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-[4-(methoxymethyl)phenyl]carbazol-3-yl]anilino)phenyl]phenyl]-9-[4-(methoxymethyl)phenyl]-N-phenylcarbazol-3-amine
CID 146848929
6-ethenyl-N-[4-(4-methylphenyl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 166763972
6-ethenyl-N-(4-methylphenyl)-N,9-diphenylcarbazol-3-amine
CID 166764286
4-(5,11-diphenyl-9,10-dihydroindolo[3,2-b]carbazol-8-yl)-N,N-diphenylaniline
CID 163457269
N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)-1,2-dihydrocarbazol-3-amine
CID 122691770
N,9-diphenyl-N-(10-phenylanthracen-9-yl)-6-(4-phenylphenyl)-7,8-dihydrocarbazol-3-amine
CID 88979154
N-phenyl-4-(4-phenylphenyl)-N-[4-[6-phenyl-9-[4-(4-phenylphenyl)phenyl]carbazol-3-yl]phenyl]aniline
CID 122524703
1-N,1-N-diphenyl-3-N-[3-(N-phenylanilino)phenyl]-3-N-[4-(9-phenylcarbazol-3-yl)phenyl]benzene-1,3-diamine
CID 177275836

Frequently Asked Questions

What is the IUPAC name of 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine?
The IUPAC name of 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine (CID 155073664) is 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine.
What is the SMILES notation for 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine?
The canonical SMILES for 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine is C=Cc1ccc(-c2ccc3c(c2)c2c(n3-c3ccccc3)CCC(N(c3ccccc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccc6c(c5)c5cc(-c7ccc(C=C)cc7)ccc5n6-c5ccccc5)cc4)cc3)=C2)cc1.
What is the InChIKey of 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine?
The InChIKey is MBBQZWLCUFKZIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C76H56N4/c1-3-53-25-29-57(30-26-53)59-37-45-73-69(49-59)71-51-67(43-47-75(71)79(73)63-21-13-7-14-22-63)77(61-17-9-5-10-18-61)65-39-33-55(34-40-65)56-35-41-66(42-36-56)78(62-19-11-6-12-20-62)68-44-48-76-72(52-68)70-50-60(58-31-27-54(4-2)28-32-58)38-46-74(70)80(76)64-23-15-8-16-24-64/h3-43,45-47,49-52H,1-2,44,48H2.
What are the key properties of 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine?
6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine has a molecular weight of 1025.31 g/mol, XLogP of 20.61, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-ethenylphenyl)-N-[4-[4-(N-[6-(4-ethenylphenyl)-9-phenyl-1,2-dihydrocarbazol-3-yl]anilino)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine is sourced from PubChem (CID 155073664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).